SCHEMBL27365070

SCHEMBL27365070

O=C(O)CCCCCn1cc(C(=O)c2ccc(O)cc2)c2ccccc21

nearest known ligand 0.68

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 6/20 0.63
CNR1 P21554 6/20 0.63
SRD5A1 P18405 4/20 0.59
SRD5A2 P31213 4/20 0.59
KMT2A Q03164 1/20 0.57
CREBBP Q92793 1/20 0.53
CCNT1 O60563 1/20 0.49
CCNA2 P20248 1/20 0.49
CDK2 P24941 1/20 0.49
CDK9 P50750 1/20 0.49

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
SCHEMBL27311977 0.95 SRD5A1 (0.64) CNR2CNR1SRD5A1SRD5A2KMT2A
SCHEMBL16201688 0.85 CNR2 (0.80) CNR2CNR1
SCHEMBL8791719 0.84 SRD5A1 (0.62) CNR2CNR1SRD5A1SRD5A2KMT2A
SCHEMBL8792188 0.82 SRD5A1 (0.63) CNR2CNR1SRD5A1SRD5A2KMT2A
SCHEMBL9390912 0.82 CNR1 (0.56) CNR2CNR1SRD5A1SRD5A2KMT2A
SCHEMBL11903696 0.81 CNR2 (0.74) CNR2CNR1
SCHEMBL8792359 0.81 SRD5A1 (0.58) CNR2CNR1SRD5A1SRD5A2KMT2A
SCHEMBL8959936 0.80 CREBBP (0.60) CNR2CNR1SRD5A1SRD5A2KMT2A
SCHEMBL11154740 0.80 CNR2 (0.67) CNR2CNR1KMT2A
SCHEMBL7853735 0.80 CNR1 (0.70) CNR2CNR1SRD5A1SRD5A2CREBBP

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
CN-1067985-C Indole derivative and medicine containing the same ZERIA PHARM CO LTD (JP) 2001-07-04 CN disclosed
CN-1145617-A Indole derivatives and drugs containing the same ZERIA PHARM CO LTD (JP) 1997-03-19 CN disclosed