SCHEMBL132620

SCHEMBL132620

S=C(Nc1ccccc1)Nc1ccccc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 7/20 1.00
▸ TAS2R38 P59533 3/20 1.00
▸ HSD17B10 Q99714 2/20 1.00
▸ CYP3A4 P08684 1/20 1.00
▸ KMT2A Q03164 5/20 0.80
▸ GAA P10253 5/20 0.80
▸ MEN1 O00255 3/20 0.80
▸ RAB9A P51151 2/20 0.80
▸ NPC1 O15118 1/20 0.80
▸ NOX1 Q9Y5S8 1/20 0.80
▸ MAOA P21397 2/20 0.77
▸ MAOB P27338 2/20 0.77
▸ LMNA P02545 2/20 0.77
▸ MAPT P10636 2/20 0.74
▸ KDM4E B2RXH2 1/20 0.65
▸ CYP1A2 P05177 1/20 0.65
▸ CYP2C19 P33261 1/20 0.65
▸ TP53 P04637 1/20 0.64
▸ TYR P14679 1/20 0.64
▸ TSHR P16473 1/20 0.64

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
SCHEMBL8956322 0.97 ALDH1A1 (0.94) ALDH1A1TAS2R38HSD17B10CYP3A4KMT2A
SCHEMBL9470190 0.97 ALDH1A1 (0.94) ALDH1A1TAS2R38HSD17B10CYP3A4KMT2A
Thiourea SCHEMBL21055683 0.92 ALDH1A1 (0.85) ALDH1A1TAS2R38HSD17B10CYP3A4KMT2A
SCHEMBL27691142 0.90 ALDH1A1 (0.81) ALDH1A1TAS2R38HSD17B10CYP3A4KMT2A
Tetramethylammonium Ion SCHEMBL28514624 0.90 ALDH1A1 (0.81) ALDH1A1TAS2R38HSD17B10CYP3A4KMT2A
SCHEMBL9243020 0.90 ALDH1A1 (0.81) ALDH1A1TAS2R38HSD17B10CYP3A4KMT2A
SCHEMBL730314 0.89 ALDH1A1 (0.80) ALDH1A1TAS2R38HSD17B10CYP3A4KMT2A
SCHEMBL11684405 0.88 ALDH1A1 (0.77) ALDH1A1TAS2R38HSD17B10CYP3A4KMT2A
Guanidine SCHEMBL28209417 0.88 ALDH1A1 (0.77) ALDH1A1TAS2R38HSD17B10CYP3A4KMT2A
SCHEMBL2235398 0.88 GAA (1.00) ALDH1A1TAS2R38HSD17B10CYP3A4KMT2A

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 3965 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4739717-A2 PREPARATION OF A HIGH REACTION TEMPERATURE DPAM HAVING IMPROVED STANDARD VISCOSITY AND WATER SOLUBILITY KEMIRA OYJ (FI) 2026-05-13 — — EP claimed
EP-3898825-B1 CAPSULES COMPRISING VULCANISATION ACCELERANT AGENTS, THEIR PREPARATION AND USE IN THE VULCANISATION OF ELASTOMERIC COMPOUNDS FOR TYRES PIRELLI (IT) 2026-04-01 — — EP claimed
EP-4025635-B1 EXPANDABLE VINYL AROMATIC POLYMERS WITH IMPROVED FLAME RETARDANCY TOTALENERGIES ONETECH BELGIUM (BE) 2025-10-15 — — EP claimed
EP-4329704-B1 INITIATOR SYSTEM WITH POLYMERIZABLE THIOUREA COMPONENT, DENTAL COMPOSITION AND USE THEREOF SOLVENTUM INTELLECTUAL PROPERTIES COMPANY (US) 2025-10-08 — — EP claimed
EP-4590782-A1 GAS-PHASE COMPOSITION FOR INHIBITING CORROSION EXPOSED TO CONDENSED WATER Arkema France (FR) 2025-07-30 — — EP claimed
CN-120118404-A Ageing-resistant low-temperature chloroprene rubber composition and preparation method thereof 中国科学院青岛生物能源与过程研究所 2025-06-10 — — CN claimed
CN-120026533-A Waste rubber asphalt pavement plant-mixing heat regeneration construction process 山西交通科学研究院集团有限公司 2025-05-23 — — CN claimed
EP-3816325-B1 ACIDIC AQUEOUS SILVER-NICKEL ALLOY ELECTROPLATING COMPOSITIONS AND METHODS DUPONT ELECTRONIC MAT INTERNATIONAL LLC (US) 2025-05-07 — — EP claimed
WO-2025082611-A1 COLLOIDAL ION-CAPPED PB CHALCOGENIDE NANOCRYSTALS FOR X-RAY APPLICATIONS QDI SYSTEMS B.V (NL) 2025-04-24 — — WO claimed
WO-2025082614-A1 COLLOIDAL ION-CAPPED PB CHALCOGENIDE NANOCRYSTALS FOR SWIR APPLICATIONS QDI SYSTEMS B.V (NL) 2025-04-24 — — WO claimed
US-4180405-A COLOR-FORMING LACTONES OR SPIROPYRANS WITH CYCLIC POLYKETO COLOR PRECURSOR GRAPHIC CONTROLS CORPORATION (US) 1979-12-25 — — US claimed
US-4177072-A HYDROPHILIC AND OLEOPHILIC AREAS FUJI PHOTO FILM CO., LTD. (JP) 1979-12-04 — — US claimed
US-4166870-A LAYER OF LATEX AND ACETYLENE GLACK VULCANIZED ON SHEET OF METAL UNIGATE LIMITED (GB) 1979-09-04 — — US claimed
US-4097288-A Heat sensitive recording composition containing a complexed phenolics and a spiropyran or leuco lactone GRAPHIC CONTROLS CORPORATION 1978-06-27 — — US claimed
US-4076530-A Dry photographic copying method for producing Te images FUJI PHOTO FILM CO., LTD. (JA) 1978-02-28 — — US claimed
US-4072712-A FROM ISOCYANATES, CATALYSIS BAYER AKTIENGESELLSCHAFT (DT) 1978-02-07 — — US claimed
US-4028272-A Process of polymerization of conjugated diolefins using iron catalysts and sulfur ligands THE GOODYEAR TIRE & RUBBER COMPANY (US) 1977-06-07 — — US claimed
US-3998894-A DIMERIZATION AND CYCLIZATION OF A STYRENE AND A HAL GENO-STYRENE BASF AKTIENGESELLSCHAFT (DT) 1976-12-21 — — US claimed
US-3977880-A Direct-positive emulsion containing silver halide grains internally doped with metal ions, surface ripened with gold and sulfur compound and fogged by light exposure FUJI PHOTO FILM CO., LTD. (JA) 1976-08-31 — — US claimed
US-3956510-A NESTING, CYLINDERS, LOOPS BEALL NELSON J 1976-05-11 — — US claimed
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