SCHEMBL1863405

SCHEMBL1863405

COc1c(C)cccc1C(N)=O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.49
HSD17B10 Q99714 4/20 0.49
HPGD P15428 4/20 0.49
KDM4E B2RXH2 3/20 0.49
NNMT P40261 2/20 0.44
PARP1 P09874 6/20 0.43
MYC P01106 1/20 0.43
LMNA P02545 2/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
MAPT P10636 2/20 0.43
NPC1 O15118 1/20 0.43
ALOX15 P16050 1/20 0.43
MAPK1 P28482 1/20 0.43
RAB9A P51151 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
HTT P42858 1/20 0.42
TSHR P16473 1/20 0.42
IRAK4 Q9NWZ3 1/20 0.42
JAK1 P23458 1/20 0.41
TYK2 P29597 1/20 0.41

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
SCHEMBL3395132 0.90 PARP1 (0.47) ALDH1A1HSD17B10HPGDKDM4ENNMT
SCHEMBL6645354 0.84 NNMT (0.49) ALDH1A1KDM4ENNMTPARP1LMNA
SCHEMBL9726590 0.83 KDM4E (0.52) ALDH1A1HSD17B10HPGDKDM4EMYC
SCHEMBL5925554 0.83 KDM4E (0.72) ALDH1A1HSD17B10HPGDKDM4EPARP1
SCHEMBL261504 0.82 MAPT (0.56) ALDH1A1HSD17B10HPGDKDM4ELMNA
SCHEMBL29430315 0.82 ALDH1A1 (0.48) ALDH1A1HSD17B10HPGDKDM4EPARP1
SCHEMBL9818242 0.82 ALDH1A1 (0.48) ALDH1A1HSD17B10HPGDKDM4EPARP1
SCHEMBL28309500 0.82 L3MBTL1 (0.45) ALDH1A1HSD17B10HPGDKDM4EPARP1
SCHEMBL305252 0.82 ALDH1A1 (0.70) ALDH1A1HSD17B10HPGDKDM4EMYC
SCHEMBL30675634 0.82 ALDH1A1 (0.70) ALDH1A1HSD17B10HPGDKDM4EMYC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116855008-A 80-year-life thermosetting sheath material for cable for nuclear power station and preparation method thereof 江苏上上电缆集团新材料有限公司 2023-10-10 CN claimed
WO-2007134421-A1 2-VINYL INDOLES, PYRIDO AND AZEPINO INDOLE DERIVATIVES, 2-ALKYNYL INDOLES, 2-ALKYNYL BENZO[b]FURANS, THEIR PRECURSORS AND NOVEL PROCESSES FOR THE PREPARATION THEREOF LAUTENS MARK (CA) 2007-11-29 WO claimed
EP-4257587-A1 HYDROXAMATE COMPOUND, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF Shenzhen Chipscreen Biosciences Co., Ltd. (CN) 2023-10-11 EP disclosed
CN-116855008-A 80-year-life thermosetting sheath material for cable for nuclear power station and preparation method thereof 江苏上上电缆集团新材料有限公司 2023-10-10 CN disclosed
US-20230271975-A1 IMIDAZOLE-CONTAINING INHIBITORS OF ALK2 KINASE WILMINGTON TRUST, NATIONAL ASSOCIATION 2023-08-31 US disclosed
US-11661426-B2 Imidazole-containing inhibitors of ALK2 kinase BIOCRYST PHARMACEUTICALS, INC. (US) 2023-05-30 US disclosed
WO-2022204363-A1 GERMINATION/SPROUTING AND FRUIT RIPENING REGULATORS THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY OF AGRICULTURE (US) 2022-09-29 WO disclosed
WO-2022117016-A1 HYDROXAMATE COMPOUND, PREPARATION METHOD THEREFOR AND APPLICATION THEREOF 深圳微芯生物科技股份有限公司 2022-06-09 WO disclosed
WO-2022100710-A1 TYROSINE KINASE 2 (TYK2) DEGRADATION COMPOUNDS AND METHODS OF USE CULLGEN (SHANGHAI) , INC. (CN) 2022-05-19 WO disclosed
EP-3720435-A1 CRYSTAL FORMS AND PRODUCTION METHODS THEREOF Sunovion Pharmaceuticals Inc. (US) 2020-10-14 EP disclosed
US-10752624-B2 Kinase inhibitors ORIGENIS GMBH (DE) 2020-08-25 US disclosed
US-20050085526-A1 Indole derivatives useful for the treatment of diseases BROWN ALAN D (GB) 2005-04-21 US disclosed
EP-1501800-A1 BOMBESIN ANTAGONISTS Warner-Lambert Company LLC (US) 2005-02-02 EP disclosed
US-6844362-B2 Indole derivatives useful for the treatment of diseases PFIZER INC (US) 2005-01-18 US disclosed
EP-1440966-A1 Indole derivatives useful for the treatment of diseases Pfizer Limited (GB) 2004-07-28 EP disclosed
US-20040116503-A1 Indole derivatives useful for the treatment of diseases PFIZER INC. 2004-06-17 US disclosed
WO-2004032921-A1 INDOLE DERIVATIVES AS BETA-2 AGONISTS PFIZER LIMITED (GB) 2004-04-22 WO disclosed
US-20040063643-A1 Bombesin antagonists PFIZER INC. 2004-04-01 US disclosed
WO-2003092670-A1 BOMBESIN ANTAGONISTS WARNER-LAMBERT COMPANY LLC (US) 2003-11-13 WO disclosed
EP-0154969-A2 Piperazine derivatives and their acid addition salts MITSUBISHI KASEI CORPORATION (JP) 1985-09-18 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-20230271975-A1 IMIDAZOLE-CONTAINING INHIBITORS OF ALK2 KINASE ALK, ACVR2B, ACVR2A ALDH1A1 980/4885HSD17B10 1857/4885HPGD 2235/4885
US-11661426-B2 Imidazole-containing inhibitors of ALK2 kinase ALK, ACVR2B, ACVR2A ALDH1A1 980/4885HSD17B10 1857/4885HPGD 2235/4885
US-20050085526-A1 Indole derivatives useful for the treatment of diseases IDO1, IDO2, INMT ALDH1A1 549/4885HSD17B10 813/4885HPGD 74/4885
US-20040063643-A1 Bombesin antagonists BRS3, NPSR1, GNRHR ALDH1A1 3777/4885HSD17B10 2627/4885HPGD 852/4885
US-10752624-B2 Kinase inhibitors LRRK2, MYLK2, MYLK ALDH1A1 4184/4885HSD17B10 4376/4885HPGD 4156/4885

“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.