SCHEMBL117208

SCHEMBL117208

Nc1ccc2[nH]ncc2c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ROCK2 O75116 4/20 1.00
MAPT P10636 3/20 1.00
KDM4E B2RXH2 2/20 1.00
MEN1 O00255 2/20 1.00
KMT2A Q03164 2/20 1.00
ROCK1 Q13464 2/20 1.00
ALDH1A1 P00352 1/20 1.00
GAA P10253 1/20 1.00
HPGD P15428 1/20 1.00
RAB9A P51151 1/20 1.00
HIF1A Q16665 1/20 1.00
TDP1 Q9NUW8 1/20 1.00
PKM P14618 1/20 0.70
HTT P42858 1/20 0.70
NOS1 P29475 4/20 0.59
METAP2 P50579 1/20 0.59
CSNK2A1 P68400 1/20 0.59
CHEK1 O14757 1/20 0.57
GSK3B P49841 3/20 0.53
CLK1 P49759 2/20 0.53

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
SCHEMBL29372553 1.00 ROCK2 (1.00) ROCK2MAPTKDM4EMEN1KMT2A
Water SCHEMBL28188426 0.98 ROCK2 (0.96) ROCK2MAPTKDM4EMEN1KMT2A
Hydrochloric Acid SCHEMBL3873262 0.98 ROCK2 (0.96) ROCK2MAPTKDM4EMEN1KMT2A
SCHEMBL7485448 0.89 ROCK2 (0.79) ROCK2MAPTKDM4EMEN1KMT2A
Trifluoroacetic Acid SCHEMBL2555084 0.83 ROCK2 (0.70) ROCK2MAPTKDM4EMEN1KMT2A
SCHEMBL29559746 0.83 MAPT (1.00) ROCK2MAPTKDM4EMEN1KMT2A
SCHEMBL177260 0.83 MAPT (1.00) ROCK2MAPTKDM4EMEN1KMT2A
Quinoline SCHEMBL27625445 0.81 MAPT (0.66) ROCK2MAPTKDM4EMEN1KMT2A
Tert-Butyl Formate SCHEMBL27634813 0.81 ROCK2 (0.66) ROCK2MAPTKDM4EMEN1KMT2A
Hydrochloric Acid SCHEMBL3871258 0.81 MAPT (0.96) ROCK2MAPTKDM4EMEN1KMT2A

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

Appears in 2758 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4680219-A2 ACETAMINOPHEN COMPOSITIONS AND METHODS OF TREATING CANCER The United States Government as represented by the Department of Veterans Affairs (US) 2026-01-21 EP claimed
US-20250223279-A1 PROCESS FOR THE PREPARATION OF BELUMOSUDIL MESYLATE AND ITS CRYSTALLINE FORM ALIVUS LIFE SCIENCES LIMITED (IN) 2025-07-10 US claimed
EP-4499600-A1 PROCESS FOR THE PREPARATION OF BELUMOSUDIL MESYLATE AND ITS CRYSTALLINE FORM Glenmark Life Sciences Limited (IN) 2025-02-05 EP claimed
CN-119223101-A Environment-friendly airport bird repellent bomb 中北大学 2024-12-31 CN claimed
EP-4357347-B1 TRK KINASE INHIBITOR COMPOUND AND USE THEREOF HENAN MEDINNO PHARMACEUTICAL TECH CO LTD (CN) 2024-12-11 EP claimed
CN-118791471-A Preparation method of besudil 斯坦德药典标准物质研发(湖北)有限公司 2024-10-18 CN claimed
WO-2024192214-A2 ACETAMINOPHEN COMPOSITIONS AND METHODS OF TREATING CANCER THE UNITED STATES GOVERNMENT AS REPRESENTED BY THE DEPARTMENT OF VETERANS AFFAIRS (US) 2024-09-19 WO claimed
WO-2024171021-A1 A PROCESS FOR THE PREPARATION OF BELUMOSUDIL AND ITS AUROBINDO PHARMA LTD (IN) 2024-08-22 WO claimed
CN-114456755-B Epoxy resin composition, preparation method and application thereof 江苏中科科化新材料股份有限公司 2024-03-12 CN claimed
CN-116285556-B Heavy anti-corrosion emulsion for roads and bridges and preparation method thereof 上海市政养护管理有限公司 2024-02-06 CN claimed
EP-0743574-A2 Migration imaging members XEROX CORPORATION (US) 1996-11-20 EP claimed
US-5563014-A SOFTENABLE LAYER CONTAINIG PHOTOSENSITIVE MARKING MATERIAL; TRANSPARENTIZING AGENT XEROX CORPORATION (US) 1996-10-08 US claimed
US-5514505-A SELECTIVE TRANSPARENTIZATION OF PHOTOSENSITIVE MIGRATION MARKING PARTICLES EMBEDDED NEAR THE SURFACE OF A SOFTENABLE LAYER SUPPORTED BY AN ELECTROCONDUCTIVE SUBSTRATE XEROX CORPORATION (US) 1996-05-07 US claimed
EP-0673782-A2 Recording sheets containing pyrrole, pyrrolidine, pyridine, piperidine, homopiperidine, quinoline, isoquinoline, quinuclidine, indole, and indazole compounds XEROX CORPORATION (US) 1995-09-27 EP claimed
EP-0170414-B1 PROCESS FOR TREATING METAL SURFACE Hitachi Chemical Co., Ltd. (JP) 1991-04-17 EP claimed
US-4753722-A OXIDATION TO DISULFIDES MERICHEM COMPANY (US) 1988-06-28 US claimed
US-4643793-A WITH MIXTURE OF COPPER COMPOUND, COMPLEXING AGENT, REDUCING AGENT, AND PH ADJUSTER IN PRESENCE OF NITROGEN HETEROCYCLE COMPOUND HITACHI CHEMICAL COMPANY, LTD. (JP) 1987-02-17 US claimed
EP-0170414-A2 Process for treating metal surface Hitachi Chemical Co., Ltd. (JP) 1986-02-05 EP claimed
US-4013404-A Method of dyeing hair with indolines, indoles and indazoles AMERICAN CYANAMID COMPANY (US) 1977-03-22 US claimed
US-3933498-A Fogged, direct positive silver halide emulsions containing a bleach inhibiting compound and a Dmin maintainer compound E. I. DU PONT DE NEMOURS AND COMPANY (US) 1976-01-20 US claimed