SCHEMBL10763327

SCHEMBL10763327

NCCCc1nc2ccccc2s1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ UBE2T Q9NPD8 1/20 0.68
▸ ASIC3 Q9UHC3 1/20 0.68
▸ SMN1; SMN2 Q16637 2/20 0.62
▸ ALOX15 P16050 1/20 0.62
▸ HTT P42858 1/20 0.62
▸ HTR1A P08908 4/20 0.56
▸ HTR7 P34969 4/20 0.56
▸ DRD2 P14416 3/20 0.56
▸ SLC6A4 P31645 2/20 0.56
▸ PDE10A Q9Y233 1/20 0.54
▸ LMNA P02545 1/20 0.54
▸ HPGD P15428 4/20 0.53
▸ RAB9A P51151 2/20 0.53
▸ ILK Q13418 1/20 0.52
▸ MAPT P10636 2/20 0.51
▸ POLB P06746 1/20 0.51
▸ ATM Q13315 1/20 0.51
▸ HRH1 P35367 2/20 0.50
▸ DRD3 P35462 2/20 0.50
▸ HTR2B P41595 2/20 0.50

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
SCHEMBL8088124 0.95 UBE2T (0.66) UBE2TASIC3SMN1; SMN2ALOX15HTT
SCHEMBL4703105 0.93 UBE2T (0.64) UBE2TASIC3SMN1; SMN2ALOX15HTT
SCHEMBL29111661 0.93 UBE2T (0.64) UBE2TASIC3SMN1; SMN2ALOX15HTT
SCHEMBL11437569 0.93 UBE2T (0.64) UBE2TASIC3SMN1; SMN2ALOX15HTT
SCHEMBL4700806 0.93 UBE2T (0.64) UBE2TASIC3SMN1; SMN2ALOX15HTT
SCHEMBL3529770 0.89 UBE2T (0.72) UBE2TASIC3SMN1; SMN2ALOX15HTT
SCHEMBL9641726 0.89 SMN1; SMN2 (0.70) UBE2TASIC3SMN1; SMN2ALOX15HTT
Hydrochloric Acid SCHEMBL12477869 0.87 UBE2T (0.70) UBE2TASIC3SMN1; SMN2ALOX15HTT
Bromide SCHEMBL11522514 0.85 SMN1; SMN2 (0.66) UBE2TASIC3SMN1; SMN2ALOX15HTT
SCHEMBL19372016 0.85 UBE2T (0.70) UBE2TASIC3SMN1; SMN2ALOX15HTT

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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4026815-A ADDING A PHOSPHONOCARBOXYLIC ACID AND A BENZIMIDAZOLE DERIVATIVE BAYER AKTIENGESELLSCHAFT (DT) 1977-05-31 — — US claimed
US-4000079-A ANTIFREEZE ADDITIVES BAYER AKTIENGESELLSCHAFT (DT) 1976-12-28 — — US claimed
CN-113024483-A Preparation method of 2-substituted benzothiazole derivative 无锡鸣鹭医药科技有限公司 2021-06-25 — — CN disclosed
EP-0226016-A1 Process for inhibiting hydrogen-induced corrosion of metallic materials BAYER AG (DE) 1987-06-24 — — EP disclosed
EP-0163458-A1 Tetrahydronaphthalenols for the treatment of hypertension E.R. Squibb & Sons, Inc. (US) 1985-12-04 — — EP disclosed
US-4235838-A IN OIL AND GAS WELLS PETROLITE CORPORATION (US) 1980-11-25 — — US disclosed
US-4026815-A ADDING A PHOSPHONOCARBOXYLIC ACID AND A BENZIMIDAZOLE DERIVATIVE BAYER AKTIENGESELLSCHAFT (DT) 1977-05-31 — — US disclosed
US-4000079-A ANTIFREEZE ADDITIVES BAYER AKTIENGESELLSCHAFT (DT) 1976-12-28 — — US disclosed
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