SCHEMBL4414699

SCHEMBL4414699

C=C/N=C1/C=C(OC)C(O)=C/C1=C(/N)Nc1ccc(F)c(Cl)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.41
HTT P42858 4/20 0.41
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
MEN1 O00255 9/20 0.40
KMT2A Q03164 9/20 0.40
CASP3 P42574 1/20 0.40
SENP7 Q9BQF6 1/20 0.40
ALDH1A1 P00352 3/20 0.37
NPSR1 Q6W5P4 3/20 0.37
TSHR P16473 3/20 0.36
LMNA P02545 2/20 0.36
SLC2A1 P11166 1/20 0.35
KDM4E B2RXH2 2/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2C9 P11712 1/20 0.35
ALOX15 P16050 1/20 0.35
CYP2C19 P33261 1/20 0.35
CSF1R P07333 1/20 0.34

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
SCHEMBL13818731 0.78 EGFR (0.45) MAPT
SCHEMBL33141 0.76 EGFR (0.48)
SCHEMBL14605834 0.76 EGFR (0.38) MAPTHTTNPC1RAB9ASMN1; SMN2
SCHEMBL12838368 0.74 MEN1 (0.33) MAPTHTTNPC1RAB9ASMN1; SMN2
SCHEMBL14147701 0.71 KDR (0.40) TSHRKDM4ECSF1R
SCHEMBL16199864 0.64 MAPT (0.43) MAPTHTTNPC1RAB9ASMN1; SMN2
SCHEMBL11884293 0.64 KMT2A (0.59) MAPTHTTNPC1RAB9ASMN1; SMN2
SCHEMBL12838303 0.62 EGFR (0.40) MAPTHTTNPC1RAB9ASMN1; SMN2
SCHEMBL4730870 0.62 MAPT (0.67) MAPTHTTNPC1RAB9ASMN1; SMN2
SCHEMBL4730873 0.62 MAPT (0.67) MAPTHTTNPC1RAB9ASMN1; 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1492536-B1 4-(N-PHENYLAMINO)-QUINAZOLINES / QUINOLINES AS TYROSINE KINASE INHIBITORS BOEHRINGER INGELHEIM PHARMA (DE) 2012-05-09 EP disclosed