SCHEMBL14366806

SCHEMBL14366806

CC1CCN(c2ccc(F)cc2)CC1c1cccc(CC(=O)O)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOTUM Q6P988 1/20 0.45
ITGB3 P05106 2/20 0.41
ITGA2B P08514 2/20 0.41
MAPT P10636 2/20 0.41
PKM P14618 1/20 0.41
ALOX12 P18054 1/20 0.41
CASR P41180 2/20 0.40
MYC P01106 1/20 0.40
WDR5 P61964 1/20 0.40
CHRM4 P08173 2/20 0.40
POLB P06746 1/20 0.39
SLC22A12 Q96S37 1/20 0.39
NPC1 O15118 1/20 0.39
RAB9A P51151 1/20 0.39
MCL1 Q07820 1/20 0.39
GFER P55789 1/20 0.38
TP53 P04637 1/20 0.38
ALDH1A1 P00352 2/20 0.37
KDM4E B2RXH2 1/20 0.37
FFAR4 Q5NUL3 1/20 0.37

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
SCHEMBL14366808 0.89 POLB (0.46) NOTUMMAPTPKMALOX12CHRM4
SCHEMBL3930700 0.71 TRPA1 (0.46) MAPTALDH1A1
SCHEMBL3932377 0.71 PKM (0.49) MAPTPKMTP53ALDH1A1KDM4E
SCHEMBL3931870 0.70 PTGDR2 (0.49) MAPTPKMPOLBALDH1A1
SCHEMBL17316810 0.70 ITGB3 (0.51) NOTUMITGB3ITGA2BCASRPOLB
SCHEMBL17316631 0.70 ITGB3 (0.51) NOTUMITGB3ITGA2BCASRPOLB
SCHEMBL17316620 0.70 ITGB3 (0.51) NOTUMITGB3ITGA2BCASRPOLB
SCHEMBL3933429 0.69 ATM (0.62) MYCNPC1RAB9AALDH1A1KDM4E
SCHEMBL3938376 0.68 PTGDR2 (0.54) MAPTPKM
SCHEMBL3933383 0.68 PTGDR2 (0.47) PKM

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
WO-2007146838-A2 SUBSTITUTED PHENYL ACETIC ACIDS AS DP-2 ANTAGONISTS ICOS CORPORATION (US) 2007-12-21 WO disclosed