SCHEMBL187434

SCHEMBL187434

O=Cc1c[nH]c2cc(F)ccc12

nearest known ligand 0.64

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TDO2 P48775 3/20 0.64
CYP2A6 P11509 2/20 0.64
KDM4E B2RXH2 1/20 0.58
ALDH1A1 P00352 1/20 0.58
MAPT P10636 1/20 0.58
IMPDH2 P12268 1/20 0.56
PLG P00747 1/20 0.55
PLAU P00749 1/20 0.55
GPR84 Q9NQS5 1/20 0.53
IDO1 P14902 1/20 0.51
PIM1 P11309 1/20 0.48
PIM3 Q86V86 1/20 0.48

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
SCHEMBL29935646 1.00 TDO2 (0.64) TDO2CYP2A6KDM4EALDH1A1MAPT
SCHEMBL7844961 0.86 CYP2A6 (0.57) TDO2CYP2A6KDM4EALDH1A1MAPT
SCHEMBL29935857 0.85 CAPN1 (0.59) TDO2CYP2A6KDM4EALDH1A1MAPT
SCHEMBL208051 0.85 CAPN1 (0.59) TDO2CYP2A6KDM4EALDH1A1MAPT
SCHEMBL15331451 0.82 CYP2A6 (0.53) TDO2CYP2A6KDM4EALDH1A1MAPT
SCHEMBL9377060 0.79 CYP2A6 (0.66) TDO2CYP2A6KDM4EALDH1A1MAPT
SCHEMBL29956305 0.79 CYP2A6 (0.66) TDO2CYP2A6KDM4EALDH1A1MAPT
SCHEMBL19178919 0.78 TDO2 (1.00) TDO2KDM4EALDH1A1MAPTGPR84
SCHEMBL639590 0.78 CYP2A6 (0.64) TDO2CYP2A6KDM4EALDH1A1MAPT
SCHEMBL1049957 0.78 PIM3 (0.65) TDO2CYP2A6KDM4EALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113164459-B Monoacylglycerol lipase modulators 詹森药业有限公司 2024-09-03 CN claimed
CN-116670127-A EGFR inhibitors and compositions and uses thereof 贝达药业股份有限公司 2023-08-29 CN claimed
CN-103755980-B A kind of preparation method of autofluorescence nano-micelle XIAMEN UNIVERSITY (CN) 2015-12-09 CN claimed
CN-103755980-A Preparation method of spontaneous fluorescence nano micelle UNIV XIAMEN 2014-04-30 CN claimed
CN-116535386-B Cyanoethylene sulfonyl anilide compound and preparation method and medical application thereof 西南大学 2025-05-27 CN disclosed
CN-116082412-B Metal complex of tail-connected TDO inhibitor and preparation method and application thereof 南京师范大学 2025-02-14 CN disclosed
US-20240408064-A1 RAS INHIBITORS, COMPOSITIONS AND METHODS OF USE THEREOF GENETOLEAD INC. (CA) 2024-12-12 US disclosed
US-20240409542-A1 NOVEL COMPOUNDS SITRYX THERAPEUTICS LIMITED (GB) 2024-12-12 US disclosed
CN-113164459-B Monoacylglycerol lipase modulators 詹森药业有限公司 2024-09-03 CN disclosed
US-20240246965-A1 NOVEL HETEROCYCLIC COMPOUNDS AND THEIR USE EQUINORM LTD 2024-07-25 US disclosed
US-12012411-B2 Viral replication inhibitors KATHOLIEKE UNIVERSITEIT LEUVEN (BE) 2024-06-18 US disclosed
CN-118139864-A New compounds 西特瑞治疗有限公司 2024-06-04 CN disclosed
WO-2004019943-A1 ANABASEINE DERIVATIVES USEFUL IN THE TREATMENT OF NEURODEGENERATIVE DISEASES MEMORY PHARMACEUTICALS CORPORATION (US) 2004-03-11 WO disclosed
EP-0812825-B1 PROPENONE DERIVATIVES KYOWA HAKKO KOGYO KK (JP) 2004-02-11 EP disclosed
US-20040023947-A1 Azepinoindole and pyridoindole derivatives as pharmaceutical agents X-CEPTOR THERAPEUTICS INC. 2004-02-05 US disclosed
WO-2003099821-A1 AZEPINOINDOLE AND PYRIDOINDOLE DERIVATIVES AS PHARMACEUTICAL AGENTS X-CEPTOR THERAPEUTICS, INC. (US) 2003-12-04 WO disclosed
WO-2003088897-A2 FAB I INHIBITORS AFFINIUM PHARMACEUTICALS, INC. (CA) 2003-10-30 WO disclosed
US-5952355-A 1-ETHER-SUBSTITUTED PHENYL-3-INDOL-3-YL-2-PROPEN-1-ONE DERIVATIVES; ANTITUMOR AND -CARCINOGENIC AGENTS; IMMUNOSUPPRESSANTS; AUTOIMMUNE DISEASES; SIDE EFFECT REDUCTION KYOWA HAKKO KOGYO CO., LTD. (JP) 1999-09-14 US disclosed
CN-1172476-A Propenone derivatives KYOWA HAKKO KOGYO KK (JP) 1998-02-04 CN disclosed
EP-0812825-A1 PROPENONE DERIVATIVES KYOWA HAKKO KOGYO CO., LTD. (JP) 1997-12-17 EP 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-20040023947-A1 Azepinoindole and pyridoindole derivatives as pharmaceutical agents HTR5A, MTNR1A, PTGDR TDO2 588/4885CYP2A6 575/4885KDM4E 4534/4885
US-20240246965-A1 NOVEL HETEROCYCLIC COMPOUNDS AND THEIR USE CNR1, CNR2, OPRK1 TDO2 3835/4885CYP2A6 82/4885KDM4E 1392/4885
US-20240408064-A1 RAS INHIBITORS, COMPOSITIONS AND METHODS OF USE THEREOF KRAS, NRAS, HRAS TDO2 4604/4885CYP2A6 3388/4885KDM4E 4019/4885
US-20240409542-A1 NOVEL COMPOUNDS CD47, GPR119, LRBA TDO2 2950/4885CYP2A6 931/4885KDM4E 1051/4885
US-12012411-B2 Viral replication inhibitors EIF2AK2, MAVS, ZC3HAV1 TDO2 3977/4885CYP2A6 3717/4885KDM4E 1372/4885

“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.