SCHEMBL14422261

SCHEMBL14422261

Clc1cccc(Cl)c1Nc1nc(-c2nc3cc(Br)ccc3[nH]2)cs1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PLAU P00749 1/20 0.44
▸ KIT P10721 7/20 0.41
▸ MEN1 O00255 3/20 0.40
▸ KMT2A Q03164 3/20 0.40
▸ MAPT P10636 2/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ NPSR1 Q6W5P4 1/20 0.40
▸ NPC1 O15118 2/20 0.40
▸ TP53 P04637 1/20 0.40
▸ ALOX15 P16050 1/20 0.40
▸ RAB9A P51151 1/20 0.40
▸ FKBP1A P62942 1/20 0.40
▸ SMN1; SMN2 Q16637 1/20 0.40
▸ PKM P14618 1/20 0.38
▸ PTGES O14684 1/20 0.37
▸ ALOX5 P09917 1/20 0.37
▸ CSNK2A2 P19784 1/20 0.36
▸ CSNK2B P67870 1/20 0.36
▸ CSNK2A1 P68400 1/20 0.36
▸ CSNK2A3 Q8NEV1 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
SCHEMBL14422260 0.78 KIT (0.45) PLAUKITMEN1KMT2AMAPT
SCHEMBL5213900 0.77 KIT (0.54) KIT
SCHEMBL5214652 0.72 KIT (0.52) KIT
SCHEMBL5219967 0.71 KIT (0.47) KITMEN1KMT2AMAPTNPSR1
SCHEMBL2360992 0.69 PTGES (0.59) PTGESCSNK2A2CSNK2B
SCHEMBL1170673 0.69 PDPK1 (0.51) ALDH1A1NPSR1NPC1TP53RAB9A
SCHEMBL28340413 0.68 MEN1 (0.68) MEN1KMT2AMAPTALDH1A1NPSR1
SCHEMBL1822777 0.68 ALOX5 (0.61) MEN1KMT2AMAPTALDH1A1NPC1
SCHEMBL3796104 0.67 PTGES (0.48) PTGESCSNK2A2CSNK2B
SCHEMBL6754599 0.67 ESR1 (0.50) ALDH1A1NPSR1NPC1TP53RAB9A

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
US-7265138-B2 Vanilloid receptor ligands and their use in treatments AMGEN INC. (US) 2007-09-04 — — US disclosed
US-7265138-B2 Vanilloid receptor ligands and their use in treatments AMGEN INC. (US) 2007-09-04 — — US disclosed
EP-1818333-A1 Vanilloid receptor ligands and their use in treatments Amgen Inc. (US) 2007-08-15 — — EP disclosed
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