SCHEMBL14182799

SCHEMBL14182799

CC1CCCCC1C(=O)CNc1ccc(-c2cc3ccc(NC(=O)c4ccccn4)cc3[nH]2)cc1

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ GRM4 Q14833 12/20 0.40
▸ KDR P35968 2/20 0.40
▸ EGFR P00533 1/20 0.40
▸ ERBB2 P04626 1/20 0.40
▸ MET P08581 1/20 0.40
▸ MERTK Q12866 1/20 0.40
▸ NPC1 O15118 4/20 0.38
▸ RAB9A P51151 4/20 0.38
▸ SMN1; SMN2 Q16637 3/20 0.38
▸ ALDH1A1 P00352 1/20 0.38
▸ KDM4E B2RXH2 1/20 0.37
▸ PKM P14618 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
SCHEMBL14182810 0.89 RAB9A (0.40) GRM4KDREGFRERBB2MET
SCHEMBL14183012 0.88 GRM4 (0.44) GRM4KDREGFRERBB2MET
SCHEMBL14182795 0.88 GRM4 (0.48) GRM4KDREGFRERBB2MET
SCHEMBL14182798 0.88 GRM4 (0.48) GRM4KDREGFRERBB2MET
SCHEMBL14183005 0.88 GRM4 (0.44) GRM4KDREGFRERBB2MET
SCHEMBL14182811 0.85 CNR1 (0.41) NPC1RAB9ASMN1; SMN2ALDH1A1
SCHEMBL14182794 0.84 KDR (0.46) GRM4KDRNPC1RAB9ASMN1; SMN2
SCHEMBL14182791 0.83 ITK (0.48) NPC1RAB9ASMN1; SMN2ALDH1A1KDM4E
SCHEMBL14182698 0.81 GRM4 (0.44) GRM4KDREGFRERBB2MET
SCHEMBL14182638 0.81 GRM4 (0.44) GRM4KDREGFRERBB2MET

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-7375118-B2 Phenyl-indole compounds for modulating IgE and Inhibiting cellular proliferation AVANIR PHARMACEUTICALS (US) 2008-05-20 — — US disclosed
US-7375118-B2 Phenyl-indole compounds for modulating IgE and Inhibiting cellular proliferation AVANIR PHARMACEUTICALS (US) 2008-05-20 — — US disclosed
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