SCHEMBL16097239

SCHEMBL16097239

C=CC(=O)Nc1cc(Br)ccc1C

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TGM2 P21980 5/20 0.54
F13A1 P00488 1/20 0.54
LMNA P02545 1/20 0.54
TGM1 P22735 1/20 0.54
TGM3 Q08188 1/20 0.54
EGFR P00533 5/20 0.47
BTK Q06187 2/20 0.46
KDM4E B2RXH2 1/20 0.43
ALDH1A1 P00352 1/20 0.43
CYP2C19 P33261 1/20 0.42
FGFR1 P11362 3/20 0.42
FGFR4 P22455 3/20 0.42
JAK3 P52333 1/20 0.40
MAPK3 P27361 1/20 0.40

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
SCHEMBL28220578 0.87 EGFR (0.56) TGM2F13A1LMNATGM1TGM3
SCHEMBL21894170 0.83 TGM2 (0.58) TGM2LMNAALDH1A1CYP2C19MAPK3
SCHEMBL22963894 0.83 ALDH1A1 (0.39) TGM2F13A1LMNATGM1TGM3
SCHEMBL31162390 0.83 TGM2 (0.58) TGM2LMNAALDH1A1CYP2C19MAPK3
SCHEMBL23293735 0.81 TGM2 (0.47) TGM2F13A1LMNATGM1TGM3
SCHEMBL11508898 0.81 TGM2 (0.61) TGM2F13A1LMNATGM1TGM3
SCHEMBL5234997 0.81 MAPK1 (0.56) LMNAKDM4EALDH1A1
SCHEMBL22749629 0.80 ALDH1A1 (0.51) LMNABTKKDM4EALDH1A1CYP2C19
SCHEMBL16104950 0.80 TGM2 (0.46) TGM2F13A1LMNATGM1TGM3
SCHEMBL16095513 0.80 TGM2 (0.54) TGM2F13A1LMNATGM1TGM3

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110746424-A MK2 inhibitors and uses thereof 西建卡尔有限责任公司 2020-02-04 CN disclosed
US-20190135835-A1 MK2 INHIBITORS AND USES THEREOF BRISTOL-MYERS SQUIBB COMPANY 2019-05-09 US disclosed
US-10138256-B2 MK2 inhibitors and uses thereof CELGENE CAR LLC (BM) 2018-11-27 US disclosed
EP-2968339-A1 MK2 INHIBITORS AND USES THEREOF Celgene Avilomics Research, Inc. (US) 2016-01-20 EP disclosed
US-20150376208-A1 MK2 INHIBITORS AND USES THEREOF CELGENE AVILOMICS RESEARCH, INC. (US) 2015-12-31 US disclosed
US-20150376208-A1 MK2 INHIBITORS AND USES THEREOF CELGENE AVILOMICS RESEARCH, INC. (US) 2015-12-31 US disclosed
US-20150376208-A1 MK2 INHIBITORS AND USES THEREOF CELGENE AVILOMICS RESEARCH, INC. (US) 2015-12-31 US disclosed
WO-2014149164-A1 MK2 INHIBITORS AND USES THEREOF CELGENE AVILOMICS RESEARCH, INC. (US) 2014-09-25 WO disclosed
WO-2014149164-A1 MK2 INHIBITORS AND USES THEREOF CELGENE AVILOMICS RESEARCH, INC. (US) 2014-09-25 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 (3 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-20150376208-A1 MK2 INHIBITORS AND USES THEREOF MKNK2, DUSP2, MKNK1 TGM2 1258/4885F13A1 4688/4885LMNA 4652/4885
US-10138256-B2 MK2 inhibitors and uses thereof MKNK2, DUSP2, MKNK1 TGM2 1258/4885F13A1 4688/4885LMNA 4652/4885
US-20190135835-A1 MK2 INHIBITORS AND USES THEREOF MKNK2, DUSP2, MKNK1 TGM2 1258/4885F13A1 4688/4885LMNA 4652/4885

“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.