SCHEMBL5422639

SCHEMBL5422639

CC(=O)Nc1ccc(NC=C2C(=O)Nc3cc(-c4ccco4)ccc32)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NTRK3 Q16288 1/20 0.43
RET P07949 1/20 0.43
LRRK2 Q5S007 1/20 0.42
ALDH1A1 P00352 3/20 0.41
RAB9A P51151 3/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
TP53 P04637 3/20 0.41
MEN1 O00255 1/20 0.41
NPC1 O15118 1/20 0.41
MAPT P10636 1/20 0.41
HPGD P15428 1/20 0.41
KMT2A Q03164 1/20 0.41
PDPK1 O15530 1/20 0.41
CSF1R P07333 1/20 0.41
TAAR1 Q96RJ0 3/20 0.40
GSK3B P49841 3/20 0.40
KIT P10721 2/20 0.40
FLT4 P35916 2/20 0.40
KDR P35968 2/20 0.40
FLT3 P36888 2/20 0.40

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
SCHEMBL5422637 1.00 NTRK3 (0.43) NTRK3RETLRRK2ALDH1A1RAB9A
SCHEMBL5432741 0.88 RET (0.46) NTRK3RETLRRK2PDPK1CSF1R
SCHEMBL5873980 0.88 RET (0.46) NTRK3RETLRRK2PDPK1CSF1R
SCHEMBL5432746 0.88 RET (0.46) NTRK3RETLRRK2PDPK1CSF1R
SCHEMBL7703527 0.85 RET (0.46) NTRK3RETLRRK2ALDH1A1MAPT
SCHEMBL7703531 0.85 RET (0.46) NTRK3RETLRRK2ALDH1A1MAPT
SCHEMBL5421327 0.83 RET (0.42) NTRK3RETLRRK2ALDH1A1CSF1R
SCHEMBL5421335 0.83 RET (0.42) NTRK3RETLRRK2ALDH1A1CSF1R
SCHEMBL5873797 0.83 RET (0.42) NTRK3RETLRRK2ALDH1A1CSF1R
SCHEMBL5427646 0.80 RET (0.42) RETALDH1A1RAB9APDPK1CSF1R

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-6350747-B1 PROTEIN SERINE/THREONINE KINASE AND PROTEIN TYROSINE KINASE ENZYME INHIBITORS; ANGIOGENESIS INHIBITORS; ANTITUMOR AND ANTIPROLIFERATIVE AGENTS GLAXO WELLCOME INC. 2002-02-26 US claimed
EP-1165514-A1 3-(ANILINOMETHYLENE) OXINDOLES AS PROTEIN TYROSINE KINASE AND PROTEIN SERINE/THREONINE KINASE INHIBITORS GLAXO GROUP LIMITED (GB) 2002-01-02 EP claimed
WO-2000056710-A1 3-(ANILINOMETHYLENE) OXINDOLES AS PROTEIN TYROSINE KINASE AND PROTEIN SERINE/THREONINE KINASE INHIBITORS GLAXO GROUP LIMITED (GB) 2000-09-28 WO claimed
US-20070213403-A1 TAMOXIFEN RESPONSE IN PRE-AND POSTMENOPAUSAL BREAST CANCER PATIENTS FORSKARPATENT I SYD AB (SE) 2007-09-13 US disclosed