SCHEMBL8467929

SCHEMBL8467929

Nc1ccc(-c2cnccn2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 1/20 0.51
CYP19A1 P11511 1/20 0.51
CYP2C9 P11712 1/20 0.51
CYP2C19 P33261 1/20 0.51
PIK3CD O00329 1/20 0.50
PIK3CA P42336 1/20 0.50
PIK3CB P42338 1/20 0.50
PI4KA P42356 1/20 0.50
PIK3CG P48736 1/20 0.50
PI4KB Q9UBF8 1/20 0.50
HSP90AA1 P07900 1/20 0.44
PRKCZ Q05513 1/20 0.44
METAP2 P50579 1/20 0.44
ALDH1A1 P00352 2/20 0.43
TP53 P04637 2/20 0.43
MAPT P10636 2/20 0.43
NPC1 O15118 2/20 0.43
RAB9A P51151 2/20 0.43
KDM4E B2RXH2 1/20 0.43
MEN1 O00255 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
SCHEMBL11541937 0.89 CYP2D6 (0.60) CYP2D6CYP19A1CYP2C9CYP2C19PIK3CD
SCHEMBL29683245 0.79 CYP19A1 (0.52) CYP2D6CYP19A1CYP2C9CYP2C19PIK3CD
SCHEMBL17246864 0.79 CYP19A1 (0.52) CYP2D6CYP19A1CYP2C9CYP2C19PIK3CD
SCHEMBL1724136 0.79 PIK3CD (0.47) CYP2D6CYP19A1CYP2C9CYP2C19PIK3CD
SCHEMBL30639581 0.79 CYP2C19 (0.49) CYP2D6CYP19A1CYP2C9CYP2C19PIK3CD
SCHEMBL27032937 0.79 CYP2C19 (0.49) CYP2D6CYP19A1CYP2C9CYP2C19PIK3CD
SCHEMBL9159421 0.79 ALDH1A1 (0.53) METAP2ALDH1A1TP53MAPTNPC1
SCHEMBL3156768 0.78 CYP2D6 (0.51) CYP2D6CYP19A1CYP2C9CYP2C19PIK3CD
SCHEMBL999538 0.78 CYP19A1 (0.51) CYP2D6CYP19A1CYP2C9CYP2C19PIK3CD
SCHEMBL31140236 0.78 CYP2D6 (0.56) CYP2D6CYP19A1CYP2C9CYP2C19PIK3CD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115943190-A Multifunctional material for temporary bonding 布鲁尔科技公司 2023-04-07 CN claimed
CN-115461471-A Chip surface connector and preparation method and application thereof 南京金斯瑞生物科技有限公司 2022-12-09 CN claimed
CN-112608474-A Polyimide film and graphite film 浙江中科玖源新材料有限公司 2021-04-06 CN claimed
CN-110003470-A A kind of polyimide material and preparation method thereof applied to flexible display substrates 中国科学院长春应用化学研究所 2019-07-12 CN claimed
CN-108368494-A Methods, compositions and uses of novel FYN kinase inhibitors 沃伦·C·刘 2018-08-03 CN claimed
US-12590071-B2 Hydrazone derivative in which terminal amine group is substituted with aryl group or heteroaryl group, and use thereof KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) 2026-03-31 US disclosed
EP-4695236-A1 SUBSTITUTED PHENYL-PIPERAZINYL BASED MODULATORS FOR THE TREATMENT OF DISEASE Soley Therapeutics, Inc. (US) 2026-02-18 EP disclosed
EP-3717459-B1 COMPOUNDS STEP PHARMA S A S (FR) 2026-01-21 EP disclosed
EP-4559908-A1 HETEROARYL DERIVATIVE COMPOUND AND USE THEREOF S2CBio Inc. (KR) 2025-05-28 EP disclosed
CN-113727972-B Novel hydrazone derivatives having terminal amine groups substituted with aryl or heteroaryl groups and use thereof 韩国科学技术研究院 2024-12-27 CN disclosed
WO-2024216094-A1 SUBSTITUTED PHENYL-PIPERAZINYL BASED MODULATORS FOR THE TREATMENT OF DISEASE SOLEY THERAPEUTICS, INC. (US) 2024-10-17 WO disclosed
WO-2024058617-A1 ANTIVIRAL USE OF HETEROARYL DERIVATIVE COMPOUND 일동제약(주) 2024-03-21 WO disclosed
WO-2015094119-A1 WNT PATHWAY MODULATORS AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2015-06-25 WO disclosed
WO-2014078294-A1 INDOLE COMPOUNDS AND THEIR USE AS ANTIMICROBIALS MEMORIAL SLOAN-KETTERING CANCER CENTER (US) 2014-05-22 WO disclosed
WO-2014060112-A1 PYRAZOLO[4,3-D]PYRIMIDINES AS KINASE INHIBITORS ORIGENIS GMBH (DE) 2014-04-24 WO disclosed
WO-2014060113-A1 NOVEL KINASE INHIBITORS ORIGENIS GMBH (DE) 2014-04-24 WO disclosed
US-20120329785-A1 Novel kinase inhibitors ORIGENIS GMBH (DE) 2012-12-27 US disclosed
US-20120329780-A1 Novel kinase inhibitors ORIGENIS GMBH (DE) 2012-12-27 US disclosed
US-5931168-A Applicator for coloring hair or fibers and methods for making and using same ABERCROMBIE TRACY HILL (US) 1999-08-03 US disclosed
US-5845653-A Applicator for coloring hair or fibers and methods for making and using same ABERCROMBIE TRACY H (US) 1998-12-08 US 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-20120329780-A1 Novel kinase inhibitors LRRK2, MYLK2, MYLK CYP2D6 3687/4885CYP19A1 2325/4885CYP2C9 3823/4885
US-20120329785-A1 Novel kinase inhibitors LRRK2, MYLK2, MYLK3 CYP2D6 4479/4885CYP19A1 4833/4885CYP2C9 4631/4885
US-12590071-B2 Hydrazone derivative in which terminal amine group is substituted with aryl group or heteroaryl group, and use thereof ABL1, TH, CYP3A43 CYP2D6 20/4885CYP19A1 1107/4885CYP2C9 57/4885

“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.