SCHEMBL9488388

SCHEMBL9488388

CCCC(c1ccc(C(=O)O)cc1OC)c1c[nH]c2ccc(CCNC(=O)N(C)C)cc12

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.42
GAA P10253 1/20 0.42
HSD17B10 Q99714 1/20 0.42
ACHE P22303 4/20 0.39
LMNA P02545 2/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
ABCG2 Q9UNQ0 1/20 0.39
KMT2A Q03164 2/20 0.38
MEN1 O00255 1/20 0.38
TRPV1 Q8NER1 2/20 0.38
MAPT P10636 1/20 0.37
SNCA P37840 1/20 0.37
MTNR1A P48039 1/20 0.36

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
SCHEMBL9491235 1.00 POLB (0.42) POLBGAAHSD17B10ACHELMNA
SCHEMBL9488618 0.94 POLB (0.41) POLBGAAHSD17B10ACHELMNA
SCHEMBL9488414 0.89 TRPV1 (0.41) POLBGAAHSD17B10ACHELMNA
SCHEMBL9373011 0.86 TSHR (0.38) POLBGAAHSD17B10LMNAMAPT
SCHEMBL10469113 0.86 FFAR1 (0.36) POLBGAAHSD17B10ACHELMNA
SCHEMBL9374981 0.86 MEN1 (0.41) KMT2AMEN1MTNR1A
SCHEMBL9488354 0.85
SCHEMBL9372351 0.84 MTNR1A (0.41) TRPV1MTNR1A
SCHEMBL9490929 0.84 KMT2A (0.43) POLBGAAHSD17B10KMT2AMEN1
SCHEMBL9490136 0.82 TRPV1 (0.41) POLBGAAHSD17B10ACHELMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0337766-B1 HETERA-ALIPHATIC CARBOXAMIDES ICI AMERICAS INC. (US) 1993-03-10 EP disclosed
US-5041460-A Antiallergens, antiinflammatory agents and leukotriene antagonists ICI AMERICAS INC. (US) 1991-08-20 US disclosed
EP-0337766-A1 Hetera-aliphatic carboxamides ICI AMERICAS INC. (US) 1989-10-18 EP disclosed