SCHEMBL6432787

SCHEMBL6432787

CC(C(=O)c1ccc(SCN(C)C)cc1)N1CCOCC1

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ HRH3 Q9Y5N1 1/20 0.45
▸ ALDH1A1 P00352 6/20 0.41
▸ TSHR P16473 5/20 0.41
▸ CYP3A4 P08684 1/20 0.41
▸ CYP2C19 P33261 1/20 0.41
▸ SMN1; SMN2 Q16637 6/20 0.40
▸ FKBP1A P62942 3/20 0.40
▸ MAPK1 P28482 2/20 0.40
▸ TP53 P04637 1/20 0.40
▸ RAB9A P51151 1/20 0.40
▸ LMNA P02545 2/20 0.40
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ KMT2A Q03164 2/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ MAPT P10636 2/20 0.37
▸ HPGD P15428 1/20 0.37
▸ KDM4E B2RXH2 1/20 0.37
▸ GAA P10253 1/20 0.37
▸ POLB P06746 1/20 0.37

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
SCHEMBL14046498 0.86 HRH3 (0.47) HRH3ALDH1A1TSHRCYP3A4CYP2C19
SCHEMBL1696905 0.81 ALDH1A1 (0.56) HRH3ALDH1A1TSHRCYP3A4CYP2C19
SCHEMBL10469275 0.78 HRH3 (0.49) HRH3ALDH1A1TSHRCYP3A4CYP2C19
SCHEMBL31510409 0.78 ALDH1A1 (0.53) HRH3ALDH1A1TSHRCYP3A4CYP2C19
Hydrochloric Acid SCHEMBL9596868 0.77 HRH3 (0.48) HRH3ALDH1A1TSHRCYP3A4CYP2C19
SCHEMBL5813245 0.77 RAB9A (0.53) HRH3ALDH1A1TSHRCYP3A4CYP2C19
SCHEMBL6432782 0.76 FKBP1A (0.45) HRH3ALDH1A1TSHRCYP3A4CYP2C19
SCHEMBL3424629 0.76 ALDH1A1 (0.51) HRH3ALDH1A1TSHRCYP3A4CYP2C19
SCHEMBL5954184 0.76 PHGDH (0.55) HRH3ALDH1A1TSHRCYP3A4CYP2C19
SCHEMBL321368 0.75 ALDH1A1 (0.67) ALDH1A1TSHRCYP3A4CYP2C19SMN1; SMN2

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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