SCHEMBL516645

SCHEMBL516645

Ic1n[nH]c2ccccc12

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.58
GAA P10253 2/20 0.58
PDPK1 O15530 1/20 0.58
CYP3A4 P08684 1/20 0.58
IDO1 P14902 3/20 0.54
ALDH1A1 P00352 3/20 0.54
ALPL P05186 1/20 0.54
HPGD P15428 1/20 0.54
TTK P33981 1/20 0.54
MAPK10 P53779 1/20 0.54
CYP1A2 P05177 1/20 0.48
FGFR1 P11362 1/20 0.47
FLT1 P17948 1/20 0.47
LRRK2 Q5S007 2/20 0.46
NPC1 O15118 1/20 0.46
TP53 P04637 1/20 0.46
RAB9A P51151 1/20 0.46
YTHDC1 Q96MU7 1/20 0.43
AURKA O14965 1/20 0.43
ITK Q08881 1/20 0.43

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
SCHEMBL30163026 1.00 KDM4E (0.58) KDM4EGAAPDPK1CYP3A4IDO1
SCHEMBL3976004 0.83 CYP1A2 (0.61) KDM4EGAAPDPK1CYP3A4IDO1
SCHEMBL1672674 0.75 IDO1 (0.78) KDM4EGAAPDPK1CYP3A4IDO1
SCHEMBL9407409 0.73 KDM4E (0.60) KDM4EGAAPDPK1CYP3A4IDO1
SCHEMBL18878 0.73 PDPK1 (1.00) KDM4EGAAPDPK1CYP3A4IDO1
SCHEMBL29481432 0.73 PDPK1 (1.00) KDM4EGAAPDPK1CYP3A4IDO1
SCHEMBL5510618 0.73 NOS1 (0.44) KDM4EGAAPDPK1CYP3A4IDO1
SCHEMBL2826429 0.73 NOS1 (0.39) PDPK1MAPK10FGFR1ITKNOS1
SCHEMBL9766383 0.73 ATM (0.57) KDM4EGAAALDH1A1HSD17B10
SCHEMBL2561174 0.71 KDM4E (0.58) KDM4EGAAPDPK1CYP3A4IDO1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024193328-A1 INDAZOLE SUBSTITUTED PODOPHYLLOTOXIN DERIVATIVE, PREPARATION METHOD THEREFOR, AND USE THEREOF 汤亚杰 2024-09-26 WO claimed
CN-115636789-A Preparation method of 3-iodoindazole 上海泰坦科技股份有限公司 2023-01-24 CN claimed
CN-110003187-B Polyfluoroalkyl substituted benzofuran compound and preparation method thereof 南京工业大学 2021-11-05 CN claimed
CN-110003187-A Polyfluoroalkyl substituted benzofuran compound and preparation method thereof 南京工业大学 2019-07-12 CN claimed
CN-107973785-A It is a kind of to be used to detect fluorescence probe of silver ion and its preparation method and application 浙江工业大学上虞研究院有限公司 2018-05-01 CN claimed
WO-2008022467-A1 2-SUBSTITUTED AZAIN DOLES AND 2 SUBSTITUTED THIENOPYRROLES, THEIR PRECURSORS AND NOVEL PROCESSES FOR THE PREPARATION THEREOF LAUTENS MARK (CA) 2008-02-28 WO claimed
US-12612424-B2 HPK1 inhibitors and uses thereof REGOR PHARMACEUTICALS, INC. (US) 2026-04-28 US disclosed
EP-4482583-B1 ZWITTERIONIC ANTIBACTERIAL COMPOUNDS HOFFMANN LA ROCHE (CH) 2026-04-01 EP disclosed
US-20260015351-A1 METHODS AND COMPOUNDS FOR INHIBITING MKK7 ENZYMES AXONIS THERAPEUTICS INC (US) 2026-01-15 US disclosed
US-20250388593-A1 CEREBLON E3 LIGASE BINDING COMPOUND, PHARMACEUTICAL COMPOSITION CONTAINING SAME, AND PRODUCTION METHOD THEREFOR MITSUBISHI TANABE PHARMA CORPORATION (JP) 2025-12-25 US disclosed
US-20250368625-A1 PIPERAZINES Grünenthal GmbH (DE) 2025-12-04 US disclosed
US-12479842-B2 Pyrido[3,2-d]pyrimidine compounds uses thereof for treating a proliferative disease UNIVERSITE DE MONTREAL (CA) 2025-11-25 US disclosed
EP-4650348-A1 CEREBLON E3 LIGASE BINDING COMPOUND, PHARMACEUTICAL COMPOSITION CONTAINING SAME, AND PRODUCTION METHOD THEREFOR Mitsubishi Tanabe Pharma Corporation (JP) 2025-11-19 EP disclosed
WO-2001057024-A1 BLOCKADE OF VOLTAGE DEPENDENT SODIUM CHANNELS UNIVERSITY COLLEGE LONDON (GB) 2001-08-09 WO disclosed
EP-1119566-A1 NOVEL HETEROCYCLYL-METHYL-SUBSTITUTED PYRAZOLES Bayer Aktiengesellschaft (DE) 2001-08-01 EP disclosed
US-6166027-A Heterocyclylmethyl-substituted pyrazole derivatives and their use for treating cardiovascular diseases BAYER AKTIENGESELLSCHAFT (DE) 2000-12-26 US disclosed
WO-2000021954-A1 NOVEL HETEROCYCLYL-METHYL-SUBSTITUTED PYRAZOLES BAYER AKTIENGESELLSCHAFT (DE) 2000-04-20 WO disclosed
CN-1241188-A Heterocyclylmethyl-substed pyrazol derivs. BAYER AG (DE) 2000-01-12 CN disclosed
EP-0934311-A2 NEW HETEROCYCLYLMETHYL-SUBSTITUTED PYRAZOL DERIVATES BAYER AG (DE) 1999-08-11 EP disclosed
WO-1998016507-A2 NEW HETEROCYCLYLMETHYL-SUBSTITUTED PYRAZOL DERIVATES AND THEIR USE FOR TREATING CARDIOVASCULAR DISEASES BAYER AKTIENGESELLSCHAFT (DE) 1998-04-23 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-12612424-B2 HPK1 inhibitors and uses thereof NEK11, NEK1, CSNK1A1 KDM4E 2717/4885GAA 4368/4885PDPK1 217/4885
US-20260015351-A1 METHODS AND COMPOUNDS FOR INHIBITING MKK7 ENZYMES PRKCSH, MAPK7, PRKCB KDM4E 1995/4885GAA 1761/4885PDPK1 2158/4885
US-12479842-B2 Pyrido[3,2-d]pyrimidine compounds uses thereof for treating a proliferative disease BRAF, NRAS, DPYD KDM4E 2840/4885GAA 2625/4885PDPK1 547/4885
US-20250388593-A1 CEREBLON E3 LIGASE BINDING COMPOUND, PHARMACEUTICAL COMPOSITION CONTAINING SAME, AND PRODUCTION METHOD THEREFOR CRBN, CUL1, CBL KDM4E 482/4885GAA 3378/4885PDPK1 3742/4885
US-20250368625-A1 PIPERAZINES SSTR4, SSTR5, SSTR2 KDM4E 3690/4885GAA 3484/4885PDPK1 1660/4885

“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.