SCHEMBL8021059

SCHEMBL8021059

CCCc1c(C(=O)C(C)C)c2c(C)cc(C(=O)O)cc2n1Cc1ccc(F)cc1Cl

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.43
SMN1; SMN2 Q16637 1/20 0.42
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
TP53 P04637 3/20 0.38
P2RX7 Q99572 4/20 0.37
POLB P06746 1/20 0.36
KDM4E B2RXH2 1/20 0.35
ALDH1A1 P00352 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2D6 P10635 1/20 0.35
CYP2C9 P11712 1/20 0.35
HPGD P15428 1/20 0.35
MAPK1 P28482 1/20 0.35
CYP2C19 P33261 1/20 0.35

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
SCHEMBL7425218 0.85 MEN1 (0.42) MAPTSMN1; SMN2MEN1KMT2ATP53
SCHEMBL7472730 0.79 MEN1 (0.39) MAPTSMN1; SMN2MEN1KMT2ATP53
SCHEMBL7428559 0.78 TP53 (0.50) MAPTSMN1; SMN2TP53P2RX7POLB
SCHEMBL7427469 0.76 AGTR1 (0.40)
SCHEMBL7418814 0.76 OXER1 (0.41) MAPTSMN1; SMN2MEN1KMT2AALDH1A1
SCHEMBL7707845 0.74 SLC22A12 (0.37)
SCHEMBL7425988 0.74 AGTR1 (0.36) ALDH1A1HPGD
SCHEMBL7427533 0.72 ALOX5AP (0.46) MEN1KMT2ATP53ALDH1A1
SCHEMBL7707842 0.72 ALOX5AP (0.45) MEN1KMT2ATP53ALDH1A1
SCHEMBL7417956 0.71 ALOX5AP (0.48) MEN1KMT2AKDM4EALDH1A1HPGD

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-6069156-A Indole derivatives as cGMP-PDE inhibitors FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 2000-05-30 US disclosed