SCHEMBL2491756

SCHEMBL2491756

Cc1c(Cl)cccc1NC(=O)C(=O)Cc1nc2ccccc2o1

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.49
THRB P10828 2/20 0.45
POLB P06746 2/20 0.45
LMNA P02545 1/20 0.45
ALDH1A1 P00352 3/20 0.45
KMT2A Q03164 3/20 0.45
SMN1; SMN2 Q16637 2/20 0.43
PTGES O14684 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.42
NPC1 O15118 1/20 0.42
RAB9A P51151 1/20 0.42

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
SCHEMBL2492488 0.77 PTPN2 (0.53) MAPTKMT2ASMN1; SMN2L3MBTL1NPC1
SCHEMBL5624696 0.69 MAPT (0.54) MAPTLMNAALDH1A1SMN1; SMN2L3MBTL1
SCHEMBL14310604 0.69 RAB9A (0.54) MAPTPOLBLMNAALDH1A1KMT2A
SCHEMBL27139465 0.69 RAB9A (0.58) MAPTLMNAALDH1A1KMT2ASMN1; SMN2
SCHEMBL13101605 0.69 RAB9A (0.50) MAPTPOLBLMNAALDH1A1KMT2A
SCHEMBL3112570 0.68 NPC1 (0.61) MAPTLMNAALDH1A1KMT2ASMN1; SMN2
SCHEMBL31614347 0.68 NPC1 (0.61) MAPTLMNAALDH1A1KMT2ASMN1; SMN2
SCHEMBL4743256 0.68 TP53 (0.54) POLBLMNAALDH1A1KMT2ASMN1; SMN2
SCHEMBL2093176 0.68 MAPT (0.69) MAPTPOLBLMNAALDH1A1KMT2A
Water SCHEMBL22499977 0.68 RAB9A (0.56) MAPTLMNAALDH1A1KMT2ASMN1; SMN2

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8330039-B2 Solar cell modules with poly(vinyl butyral) encapsulant comprising unsaturated heterocyclic compound E I DU PONT DE NEMOURS AND COMPANY (US) 2012-12-11 US disclosed
EP-2380208-A1 SOLAR CELL MODULES WITH POLY(VINYL BUTYRAL) ENCAPSULANT COMPRISING UNSATURATED HETEROCYCLIC COMPOUND E. I. du Pont de Nemours and Company (US) 2011-10-26 EP disclosed
WO-2010085664-A1 SOLAR CELL MODULES WITH POLY(VINYL BUTYRAL) ENCAPSULANT COMPRISING UNSATURATED HETEROCYCLIC COMPOUND E. I. DU PONT DE NEMOURS AND COMPANY (US) 2010-07-29 WO disclosed
US-20100180947-A1 SOLAR CELL MODULES WITH POLY(VINYL BUTYRAL) ENCAPSULANT COMPRISING UNSATURATED HETEROCYCLIC COMPOUND E. I. DU PONT DE NEMOURS AND COMPANY (US) 2010-07-22 US disclosed