SCHEMBL8405260

SCHEMBL8405260

C=Cc1ccc(C=CCCCCCCCCCCCN)cc1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.41
TNNC1 P63316 1/20 0.38
HDAC8 Q9BY41 3/20 0.35
HDAC1 Q13547 2/20 0.35
ADORA3 P0DMS8 1/20 0.34
TSHR P16473 1/20 0.32
HDAC3 O15379 1/20 0.32
HDAC4 P56524 1/20 0.32
HDAC7 Q8WUI4 1/20 0.32
HDAC2 Q92769 1/20 0.32
HDAC10 Q969S8 1/20 0.32
HDAC11 Q96DB2 1/20 0.32
HDAC6 Q9UBN7 1/20 0.32
HDAC9 Q9UKV0 1/20 0.32
HDAC5 Q9UQL6 1/20 0.32

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
SCHEMBL11587602 0.82 TNNC1 (0.38) TNNC1HDAC8HDAC1
SCHEMBL1140653 0.81 TNNC1 (0.51) ALDH1A1TNNC1TSHR
SCHEMBL1140656 0.81 TNNC1 (0.51) ALDH1A1TNNC1TSHR
SCHEMBL8756509 0.81 APP (0.44) ALDH1A1TNNC1HDAC8HDAC1HDAC6
SCHEMBL8756586 0.81 APP (0.44) ALDH1A1TNNC1HDAC8HDAC1HDAC6
SCHEMBL1368774 0.81 IDO1 (0.47) HDAC8HDAC1HDAC3HDAC4HDAC7
SCHEMBL28946124 0.81 IDO1 (0.47) HDAC8HDAC1HDAC3HDAC4HDAC7
SCHEMBL1880845 0.81 IDO1 (0.47) HDAC8HDAC1HDAC3HDAC4HDAC7
SCHEMBL7901409 0.81 IDO1 (0.47) HDAC8HDAC1HDAC3HDAC4HDAC7
SCHEMBL7915166 0.81 IDO1 (0.47) HDAC8HDAC1HDAC3HDAC4HDAC7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5985012-A SELF-POLISHING PAINT COMPRISING ANTIFOULING AGENT AND RESIN VEHICLE COMPRISING VINYL POLYMER HAVING PRIMARY AMINE PENDANT GROUPS BOUND BY REACTION WITH PENDANT CARBONYL GROUPS NIPPON PAINT CO., LTD. (JP) 1999-11-16 US disclosed
EP-0849290-A1 RESIN CONTAINING AMINE BONDED THERETO AND ANTIFOULING PAINT Nippon Paint Co., Ltd. (JP) 1998-06-24 EP disclosed