SCHEMBL4553753

SCHEMBL4553753

CCc1ccc2cc(-c3ccccc3)c(C(=O)C(=O)Nc3ccc(N(C)CCNc4cc(C)cc(C)n4)cc3)n2c1

nearest known ligand 0.42

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LMNA P02545 7/20 0.42
SMN1; SMN2 Q16637 5/20 0.42
HTT P42858 4/20 0.42
MAPT P10636 8/20 0.40
ALDH1A1 P00352 7/20 0.40
THRB P10828 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
RXFP1 Q9HBX9 2/20 0.34
MEN1 O00255 1/20 0.33
TP53 P04637 1/20 0.33
KMT2A Q03164 1/20 0.33
USP2 O75604 1/20 0.31
KDM4E B2RXH2 2/20 0.31
NPC1 O15118 1/20 0.31
GAA P10253 1/20 0.31
RAB9A P51151 1/20 0.31
CASR P41180 1/20 0.30
GBA1 P04062 1/20 0.30
PHGDH O43175 1/20 0.30

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
SCHEMBL2232559 0.93 LMNA (0.42) LMNASMN1; SMN2HTTMAPTALDH1A1
SCHEMBL1644600 0.91 SMN1; SMN2 (0.41) LMNASMN1; SMN2HTTMAPTALDH1A1
SCHEMBL1647300 0.90 SMN1; SMN2 (0.51) LMNASMN1; SMN2HTTMAPTALDH1A1
SCHEMBL2231070 0.89 LMNA (0.40) LMNASMN1; SMN2HTTMAPTALDH1A1
SCHEMBL1645552 0.87 SMN1; SMN2 (0.43) LMNASMN1; SMN2HTTMAPTALDH1A1
SCHEMBL1989148 0.84 SMN1; SMN2 (0.36) LMNASMN1; SMN2HTTMAPTALDH1A1
SCHEMBL2232421 0.84 SMN1; SMN2 (0.39) LMNASMN1; SMN2HTTMAPTALDH1A1
SCHEMBL2230727 0.82 SMN1; SMN2 (0.42) LMNASMN1; SMN2HTTMAPTALDH1A1
SCHEMBL1644586 0.81 LMNA (0.44) LMNASMN1; SMN2HTTMAPTALDH1A1
SCHEMBL1646507 0.80 LMNA (0.43) LMNASMN1; SMN2HTTMAPTALDH1A1

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
EP-2097413-A1 2-[(2-SUBSTITUTED)-IND0LIZIN-3-YL]-2-OXO-ACETAMIDE DERIVATIVES AS ANTIFUNGAL AGENTS F2G Limited (GB) 2009-09-09 EP disclosed
WO-2008062182-A1 2- [ (2-SUBSTITUTED) -IND0LIZIN-3-YL] -2-OXO-ACETAMIDE DERIVATIVES AS ANTIFUNGAL AGENTS F2G LTD (GB) 2008-05-29 WO disclosed