SCHEMBL80142

SCHEMBL80142

c1ccc(-c2ccc[nH]2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 1/20 0.48
HDAC6 Q9UBN7 1/20 0.48
NOTUM Q6P988 2/20 0.44
CYP3A4 P08684 1/20 0.44
IDO1 P14902 1/20 0.44
KDM4E B2RXH2 2/20 0.43
GAA P10253 2/20 0.43
GFER P55789 1/20 0.43
CSF1R P07333 1/20 0.42
ALDH1A1 P00352 1/20 0.42
ADORA2A P29274 1/20 0.41
SCN4A P35499 1/20 0.41
HCAR2 Q8TDS4 1/20 0.40
MAPT P10636 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
MTOR P42345 1/20 0.39
ADK P55263 1/20 0.39
NISCH Q9Y2I1 1/20 0.39
RAB9A P51151 2/20 0.38
POLB P06746 1/20 0.38

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
SCHEMBL28212557 0.97 HDAC1 (0.47) HDAC1HDAC6NOTUMCYP3A4IDO1
SCHEMBL27882289 0.97 HDAC1 (0.47) HDAC1HDAC6NOTUMCYP3A4IDO1
SCHEMBL27515517 0.97 HDAC1 (0.47) HDAC1HDAC6NOTUMCYP3A4IDO1
Fluoride SCHEMBL30394298 0.97 HDAC1 (0.47) HDAC1HDAC6NOTUMCYP3A4IDO1
SCHEMBL27462334 0.95 HDAC1 (0.50) HDAC1HDAC6NOTUMCYP3A4IDO1
Fluoride SCHEMBL27588272 0.93 HDAC1 (0.48) HDAC1HDAC6NOTUMCYP3A4IDO1
SCHEMBL380666 0.92
Hydrochloric Acid SCHEMBL3824245 0.89 HDAC6 (0.48) HDAC1HDAC6NOTUMCYP3A4IDO1
Methane SCHEMBL28805002 0.89 HDAC1 (0.46) HDAC1HDAC6NOTUMCYP3A4IDO1
SCHEMBL9419852 0.88 HDAC6 (0.57) HDAC1HDAC6CSF1RHCAR2CNR1

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 7919 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250351825-A1 AGRICULTURAL COMPOSITIONS FOR PROTECTING PLANTS AGAINST ABIOTIC STRESSORS SPOGEN BIOTECH INC (US) 2025-11-20 US claimed
EP-4649827-A2 FUNGICIDAL MIXTURES ADAMA MAKHTESHIM LTD. (IL) 2025-11-19 EP claimed
EP-4637347-A1 OIL FLOWABLE APYRASE INHIBITOR FORMULATION Texas Crop Science, Inc. (US) 2025-10-29 EP claimed
US-20250302040-A1 FUNGICIDAL COMBINATIONS OF FLUAZINAM AND USES THEREOF ADAMA MAKHTESHIM LTD. (IL) 2025-10-02 US claimed
EP-4618758-A1 MIXTURES OF SUCCINATE DEHYDROGENASE INHIBITORS AND PICOLINAMIDES FMC Corporation (US) 2025-09-24 EP claimed
US-20250287934-A1 METHOD OF FUNGICIDAL TREATMENT TO HARVESTED CROPS SYNGENTA CROP PROTECTION AG (CH) 2025-09-18 US claimed
EP-4608136-A1 WATER DISPERSIBLE GRANULE ACYLHYDRAZONE APYRASE INHIBITOR FORMULATION Texas Crop Science, Inc. (US) 2025-09-03 EP claimed
EP-4604724-A1 SUSPENSION CONCENTRATE ACYLHYDRAZONE APYRASE INHIBITOR FORMULATION Texas Crop Science, Inc. (US) 2025-08-27 EP claimed
CN-120166922-A Apyrase inhibitors 德州作物科学股份有限公司 2025-06-17 CN claimed
US-20250185655-A1 PHEROMONE COMPOSITIONS, METHODS OF MAKING, AND THEIR USES PHERONYM INC. (US) 2025-06-12 US claimed
CN-1094221-A Fungicidal active substance combinations BAYER AG (DE) 1994-11-02 CN claimed
EP-0241053-B1 ARYL-SUBSTITUTED (N-PIPERIDINYL)-METHYL- AND (N-PIPERAZINYL) METHYLAZOLES HAVING ANTIPSYCHOTIC PROPERTIES DUPHAR INTERNATIONAL RESEARCH B.V (NL) 1992-11-11 EP claimed
US-4960689-A SILVER HALIDE EMULSION LAYER CONTAINING A SENSITIZING CYANINE DYE FUJI PHOTO FILM CO., LTD. (JP) 1990-10-02 US claimed
US-4925901-A STORAGE STAABILITY, ONIUM ION CATALYST THE DOW CHEMICAL COMPANY (US) 1990-05-15 US claimed
EP-0351641-A1 1-Phenylpyrrole NIHON BAYER AGROCHEM K.K. (JP) 1990-01-24 EP claimed
EP-0339422-A1 3-Cyano-4-phenyl-pyrrole derivatives BAYER AG (DE) 1989-11-02 EP claimed
EP-0339417-A1 3-Cyano-4-phenyl-pyrroles BAYER AG (DE) 1989-11-02 EP claimed
EP-0289070-A1 Tertiary arylethyl amine derivatives having opiate-antagonistic activity DUPHAR INTERNATIONAL RESEARCH B.V (NL) 1988-11-02 EP claimed
EP-0241053-A1 Aryl-substituted (N-piperidinyl)-methyl- and (N-piperazinyl) methylazoles having antipsychotic properties DUPHAR INTERNATIONAL RESEARCH B.V (NL) 1987-10-14 EP claimed
US-4013638-A VULCANIZATION ACCELERATORS, OXIDATION INHIBITORS OF RUBBER MONSANTO COMPANY (US) 1977-03-22 US claimed