SCHEMBL6432782

SCHEMBL6432782

CC(C(=O)c1ccc(SC(C)(C)N)cc1)N1CCOCC1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FKBP1A P62942 1/20 0.45
▸ ALDH1A1 P00352 7/20 0.44
▸ TSHR P16473 5/20 0.44
▸ SMN1; SMN2 Q16637 4/20 0.44
▸ MAPK1 P28482 1/20 0.44
▸ HRH3 Q9Y5N1 1/20 0.43
▸ CYP3A4 P08684 2/20 0.42
▸ CYP2C19 P33261 1/20 0.42
▸ LMNA P02545 2/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ KMT2A Q03164 2/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ AAK1 Q2M2I8 1/20 0.38
▸ MAPT P10636 3/20 0.38
▸ KDM4E B2RXH2 1/20 0.38
▸ GAA P10253 1/20 0.38
▸ POLB P06746 1/20 0.38
▸ HTT P42858 1/20 0.38
▸ HIF1A Q16665 1/20 0.36
▸ NPC1 O15118 1/20 0.36

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
SCHEMBL1696905 0.82 ALDH1A1 (0.56) FKBP1AALDH1A1TSHRSMN1; SMN2MAPK1
SCHEMBL10469275 0.79 HRH3 (0.49) ALDH1A1TSHRSMN1; SMN2HRH3CYP3A4
SCHEMBL31510409 0.79 ALDH1A1 (0.53) ALDH1A1TSHRSMN1; SMN2MAPK1HRH3
SCHEMBL14046498 0.79 HRH3 (0.47) FKBP1AALDH1A1TSHRSMN1; SMN2MAPK1
Hydrochloric Acid SCHEMBL9596868 0.78 HRH3 (0.48) ALDH1A1TSHRSMN1; SMN2HRH3CYP3A4
SCHEMBL5813245 0.78 RAB9A (0.53) ALDH1A1TSHRSMN1; SMN2MAPK1HRH3
SCHEMBL5954184 0.76 PHGDH (0.55) ALDH1A1TSHRSMN1; SMN2HRH3CYP3A4
SCHEMBL3424629 0.76 ALDH1A1 (0.51) ALDH1A1TSHRSMN1; SMN2MAPK1HRH3
SCHEMBL321368 0.76 ALDH1A1 (0.67) ALDH1A1TSHRSMN1; SMN2MAPK1CYP3A4
SCHEMBL6432787 0.76 HRH3 (0.45) FKBP1AALDH1A1TSHRSMN1; SMN2MAPK1

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-5667541-A BINDER FROM FREE RADICAL POLYMERIZED ACRYLATED RESINS MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1997-09-16 — — US claimed
EP-0654323-B1 Coatable composition and methods of making abrasive articles MINNESOTA MINING & MFG (US) 2005-04-20 — — EP disclosed
US-5667541-A BINDER FROM FREE RADICAL POLYMERIZED ACRYLATED RESINS MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1997-09-16 — — US disclosed
EP-0654323-A1 Coatable compositions, abrasive articles made therefrom, and methods of making and using same MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1995-05-24 — — EP disclosed
US-5145885-A Morpholine compound, binders CIBA-GEIGY CORPORATION (US) 1992-09-08 — — US disclosed
US-4992547-A Aminoaryl ketone photoinitiators CIBA-GEIGY CORPORATION (US) 1991-02-12 — — US disclosed
US-4582862-A QUICK-SETTING PRINTING INKS BASED ON ACRYLATED RESINS CIBA-GEIGY CORPORATION (US) 1986-04-15 — — US disclosed
EP-0088050-A2 Coloured photo-hardenable composition CIBA-GEIGY AG (CH) 1983-09-07 — — EP disclosed
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