SCHEMBL9512665

SCHEMBL9512665

CC(CN(C)C)Sc1nc2ccccc2[nH]1

nearest known ligand 0.65

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 2/20 0.65
▸ SMN1; SMN2 Q16637 4/20 0.57
▸ RAB9A P51151 4/20 0.57
▸ NPC1 O15118 3/20 0.57
▸ ALDH1A1 P00352 2/20 0.55
▸ BCHE P06276 1/20 0.51
▸ TXN P10599 2/20 0.50
▸ MYC P01106 1/20 0.50
▸ HPGD P15428 1/20 0.47
▸ EPHX2 P34913 1/20 0.47
▸ AR P10275 1/20 0.46

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
SCHEMBL9514715 0.80 POLB (0.71) POLBSMN1; SMN2RAB9ANPC1ALDH1A1
SCHEMBL12368481 0.79 POLB (1.00) POLBSMN1; SMN2RAB9ANPC1BCHE
SCHEMBL10894311 0.77 SMN1; SMN2 (0.68) POLBSMN1; SMN2RAB9ANPC1ALDH1A1
SCHEMBL10644884 0.76 SMN1; SMN2 (0.63) POLBSMN1; SMN2RAB9ANPC1ALDH1A1
SCHEMBL10644621 0.76 POLB (0.69) POLBSMN1; SMN2RAB9ANPC1BCHE
SCHEMBL11108446 0.74 SMN1; SMN2 (0.64) POLBSMN1; SMN2RAB9ANPC1ALDH1A1
SCHEMBL9519998 0.74 TAAR1 (0.55) POLBSMN1; SMN2RAB9ANPC1ALDH1A1
SCHEMBL9676986 0.73 POLB (0.60) POLBSMN1; SMN2RAB9ANPC1ALDH1A1
SCHEMBL9512670 0.73 ALDH1A1 (0.83) POLBSMN1; SMN2RAB9ANPC1ALDH1A1
SCHEMBL7745152 0.72 RAB9A (1.00) POLBSMN1; SMN2RAB9ANPC1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0334818-B1 Pharmacologically active alkylthiobenz imidazole derivatives and process for the preparation thereof DOMPE FARMACEUTICI SPA (IT) 1993-12-01 — — EP disclosed
US-4983620-A ANTIHISTAMINES, ANTIALLERGENS DOMPE FARMACEUTICI S.P.A. (IT) 1991-01-08 — — US disclosed
EP-0334818-A1 Pharmacologically active alkylthiobenz imidazole derivatives and process for the preparation thereof DOMPE' FARMACEUTICI S.p.A. (IT) 1989-09-27 — — EP disclosed
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