SCHEMBL7444281

SCHEMBL7444281

CCCCOc1ccc(NC(=O)N2CCC(NCC(O)C3COc4ccccc4O3)CC2)cc1

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 1/20 0.46
KMT2A Q03164 2/20 0.43
MAPT P10636 6/20 0.42
LMNA P02545 1/20 0.42
RXFP1 Q9HBX9 1/20 0.42
FAAH O00519 1/20 0.42
RECQL P46063 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
THRB P10828 2/20 0.40
KDM4E B2RXH2 1/20 0.40
POLB P06746 1/20 0.40
GAA P10253 1/20 0.40
ALDH1A1 P00352 1/20 0.40
ADRB1 P08588 1/20 0.39
ADRB3 P13945 1/20 0.39
S1PR2 O95136 1/20 0.39
KCNH2 Q12809 1/20 0.39
SCN9A Q15858 1/20 0.39

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
SCHEMBL7438986 0.90 SMN1; SMN2 (0.50) KMT2AMAPTLMNAFAAHSMN1; SMN2
SCHEMBL7435658 0.89 CNR2 (0.44) KMT2AMAPTLMNASMN1; SMN2POLB
SCHEMBL7431389 0.88 HPGD (0.51) KMT2AMAPTLMNASMN1; SMN2POLB
SCHEMBL7428109 0.87 LMNA (0.52) KMT2AMAPTLMNAFAAHSMN1; SMN2
SCHEMBL7431708 0.87 FAAH (0.45) MAPTLMNAFAAHSMN1; SMN2KDM4E
SCHEMBL7434127 0.85 ALOX5 (0.47) KMT2AMAPTLMNAFAAHSMN1; SMN2
SCHEMBL7446120 0.82 MAPT (0.44) KMT2AMAPTLMNASMN1; SMN2KDM4E
SCHEMBL7437962 0.81 POLB (0.47) NAMPTKMT2AMAPTLMNAKDM4E
SCHEMBL7440356 0.80 POLB (0.43) KMT2AMAPTLMNASMN1; SMN2POLB
SCHEMBL7437912 0.80 KDM4E (0.49) KMT2AMAPTKDM4EGAAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4499100-A CARDIOUVASCULAR DISORDERS SYNTEX (U.S.A.) INC. (US) 1985-02-12 US disclosed