SCHEMBL2883773

SCHEMBL2883773

Cc1ccc(NC(=O)c2cccc(C(F)(F)F)c2)cc1I

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.68
HTT P42858 1/20 0.68
RAB9A P51151 1/20 0.68
KMT2A Q03164 1/20 0.68
BRAF P15056 8/20 0.68
KCNK3 O14649 2/20 0.67
KCNK9 Q9NPC2 1/20 0.67
CSF1R P07333 3/20 0.65
GAA P10253 1/20 0.64
MAPT P10636 1/20 0.64
KIT P10721 2/20 0.64
LCK P06239 2/20 0.64
MAPK14 Q16539 2/20 0.64
ABL1 P00519 1/20 0.64
SRC P12931 1/20 0.64
P2RX1 P51575 1/20 0.63
LMNA P02545 1/20 0.63
PTGS1 P23219 2/20 0.62
KDR P35968 1/20 0.61
BTK Q06187 1/20 0.61

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL2975743 0.90 MAPT (0.68) MEN1HTTRAB9AKMT2AKCNK3
SCHEMBL2974812 0.90 MEN1 (0.68) MEN1HTTRAB9AKMT2ABRAF
SCHEMBL29561542 0.90 MAPT (0.68) MEN1HTTRAB9AKMT2AKCNK3
SCHEMBL17316210 0.88 HDAC3 (0.58) MEN1HTTRAB9AKMT2ABRAF
SCHEMBL12858422 0.88 MEN1 (0.73) MEN1HTTRAB9AKMT2ABRAF
SCHEMBL24249928 0.86 MEN1 (0.70) MEN1HTTRAB9AKMT2ABRAF
SCHEMBL2858703 0.86 MAPT (0.70) MEN1HTTRAB9AKMT2ABRAF
SCHEMBL5261291 0.85 MAPT (0.62) MEN1HTTRAB9AKMT2AKCNK3
SCHEMBL22065317 0.85 BRAF (0.72) MEN1HTTRAB9AKMT2ABRAF
SCHEMBL18775272 0.85 KCNK3 (0.53) MEN1HTTRAB9AKMT2ABRAF

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 43 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3795571-B1 ALKYNYL(HETERO)AROMATIC COMPOUND FOR INHIBITING PROTEIN KINASE ACTIVITY SHENZHEN TARGETRX INC (CN) 2024-05-08 EP disclosed
US-11840535-B2 Alkynyl(hetero)aromatic compound for inhibiting protein kinase activity SHENZHEN TARGETRX, INC. (CN) 2023-12-12 US disclosed
CN-116761801-A Heterocyclic compounds having protein kinase inhibitory activity, pharmaceutical compositions containing the same, and methods of preparing and using the same 四川科伦博泰生物医药股份有限公司 2023-09-15 CN disclosed
US-11746110-B2 Alkynyl (hetero) aromatic ring compounds used for inhibiting protein kinase activity SHENZHEN TARGETRX, INC. (CN) 2023-09-05 US disclosed
US-11746110-B2 Alkynyl (hetero) aromatic ring compounds used for inhibiting protein kinase activity SHENZHEN TARGETRX, INC. (CN) 2023-09-05 US disclosed
US-11746110-B2 Alkynyl (hetero) aromatic ring compounds used for inhibiting protein kinase activity SHENZHEN TARGETRX, INC. (CN) 2023-09-05 US disclosed
EP-3808746-B1 N-[3-[2-[8-[(1H-PYRAZOL-4-YL)AMINO]IMIDAZO[1,2-A]PYRAZIN-3-YL]ETHYNYL]PHENYL]-BENZAMIDE DERIVATIVES AND RELATED COMPOUNDS AS PROTEIN KINASE INHIBITORS FOR THE TREATMENT OF CANCER SHENZHEN TARGETRX INC (CN) 2023-08-02 EP disclosed
EP-3808746-B1 N-[3-[2-[8-[(1H-PYRAZOL-4-YL)AMINO]IMIDAZO[1,2-A]PYRAZIN-3-YL]ETHYNYL]PHENYL]-BENZAMIDE DERIVATIVES AND RELATED COMPOUNDS AS PROTEIN KINASE INHIBITORS FOR THE TREATMENT OF CANCER SHENZHEN TARGETRX INC (CN) 2023-08-02 EP disclosed
WO-2022188792-A1 HETEROCYCLIC COMPOUND HAVING PROTEIN KINASE INHIBITORY ACTIVITY, PHARMACEUTICAL COMPOSITION COMPRISING SAME, PREPARATION METHOD THEREFOR, AND USE THEREOF 四川科伦博泰生物医药股份有限公司 2022-09-15 WO disclosed
CN-110272426-B Alkynyl (hetero) aromatic ring compounds for inhibiting protein kinase activity 深圳市塔吉瑞生物医药有限公司 2022-05-31 CN disclosed
US-8071609-B2 Unsaturated heterocyclic derivatives ARIAD PHARMACEUTICALS, INC. (US) 2011-12-06 US disclosed
US-20100197688-A1 EPHA4 RTK INHIBITORS FOR TREATMENT OF NEUROLOGICAL AND NEURODEGENERATIVE DISORDERS AND CANCER MSD K.K. (JP) 2010-08-05 US disclosed
US-20100197688-A1 EPHA4 RTK INHIBITORS FOR TREATMENT OF NEUROLOGICAL AND NEURODEGENERATIVE DISORDERS AND CANCER MSD K.K. (JP) 2010-08-05 US disclosed
US-20100197688-A1 EPHA4 RTK INHIBITORS FOR TREATMENT OF NEUROLOGICAL AND NEURODEGENERATIVE DISORDERS AND CANCER MSD K.K. (JP) 2010-08-05 US disclosed
EP-2121692-A1 SUBSTITUTED HETEROCYCLES AS JANUS KINASE INHIBITORS Incyte Corporation (US) 2009-11-25 EP disclosed
US-20090156596-A1 Unsaturated Heterocyclic Derivatives TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2009-06-18 US disclosed
US-20080188500-A1 e.g. N-[4-methyl-3-(9H-pyrimido[4,5-b]indol-7-yl)phenyl]-3-(trifluoromethyl)benzamide; Janus kinases inhibitor; anticarcinogenic agent; immune-related diseases, skin disorders, myeloid proliferative disorders INCYTE CORPORATION 2008-08-07 US disclosed
EP-1940843-A2 UNSATURATED HETEROCYCLIC DERIVATIVES ARIAD PHARMACEUTICALS, INC. (US) 2008-07-09 EP disclosed
WO-2008079965-A1 SUBSTITUTED HETEROCYCLES AS JANUS KINASE INHIBITORS INCYTE CORPORATION (US) 2008-07-03 WO disclosed
WO-2007021937-A2 UNSATURATED HETEROCYCLIC DERIVATIVES ARIAD PHARMACEUTICALS, INC. (US) 2007-02-22 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (5 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090156596-A1 Unsaturated Heterocyclic Derivatives CYP2F1, CYP2J2, ALOX5 MEN1 1262/4885HTT 3879/4885RAB9A 3985/4885
US-11746110-B2 Alkynyl (hetero) aromatic ring compounds used for inhibiting protein kinase activity ALK, WEE1, WEE2 MEN1 3008/4885HTT 2146/4885RAB9A 2022/4885
US-20080188500-A1 e.g. N-[4-methyl-3-(9H-pyrimido[4,5-b]indol-7-yl)phenyl]-3-(trifluoromethyl)benzamide; Janus kinases inhibitor; anticarcinogenic agent; immune-related diseases, skin disorders, myeloid proliferative disorders JAK3, JAK1, JAK2 MEN1 2267/4885HTT 3608/4885RAB9A 3103/4885
US-20100197688-A1 EPHA4 RTK INHIBITORS FOR TREATMENT OF NEUROLOGICAL AND NEURODEGENERATIVE DISORDERS AND CANCER EPHA4, EPHA1, ERBB4 MEN1 2411/4885HTT 393/4885RAB9A 1444/4885
US-11840535-B2 Alkynyl(hetero)aromatic compound for inhibiting protein kinase activity ALK, BRAF, DSTYK MEN1 3191/4885HTT 1256/4885RAB9A 945/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.