SCHEMBL3934792

SCHEMBL3934792

CCOc1ccc(C(=O)Nc2ccc(Cl)c(C(=O)Nc3cccnc3)c2)cc1

nearest known ligand 0.70

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CSF1R P07333 10/20 0.70
NPC1 O15118 4/20 0.67
RAB9A P51151 4/20 0.67
TSHR P16473 1/20 0.64
BRAF P15056 1/20 0.62
ALDH1A1 P00352 1/20 0.61
SMN1; SMN2 Q16637 1/20 0.61
MAPT P10636 1/20 0.60
PKM P14618 1/20 0.60
TP53 P04637 1/20 0.60
TAS1R3 Q7RTX0 1/20 0.59
TAS1R1 Q7RTX1 1/20 0.59

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
SCHEMBL3941536 0.89 BRAF (0.79) CSF1RNPC1RAB9ATSHRBRAF
SCHEMBL3938624 0.89 CSF1R (0.81) CSF1RRAB9ABRAFALDH1A1PKM
SCHEMBL3936075 0.82 CSF1R (1.00) CSF1RNPC1RAB9ABRAF
SCHEMBL3932029 0.82 MAPK1 (0.79) CSF1RNPC1RAB9ATSHRBRAF
SCHEMBL3938361 0.82 CSF1R (0.84) CSF1RRAB9ATSHRBRAFALDH1A1
SCHEMBL3942712 0.81 CSF1R (1.00) CSF1RNPC1BRAF
SCHEMBL3934338 0.81 NPC1 (0.78) CSF1RNPC1RAB9ATSHRBRAF
SCHEMBL3932812 0.81 CSF1R (1.00) CSF1RNPC1BRAF
SCHEMBL3936904 0.80 CSF1R (1.00) CSF1RRAB9ATSHRBRAFALDH1A1
SCHEMBL3944209 0.80 CSF1R (0.74) CSF1RNPC1RAB9ABRAFALDH1A1

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-1831198-B1 PYRIDINE CARBOXAMIDE DERIVATIVES FOR USE AS ANTICANCER AGENTS ASTRAZENECA AB (SE) 2009-04-08 EP disclosed