SCHEMBL169574

SCHEMBL169574

Cc1cc(F)ccc1NC(=O)c1cc[nH]n1

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 5/20 0.47
ALDH1A1 P00352 3/20 0.43
MAPT P10636 3/20 0.43
LMNA P02545 2/20 0.43
KDM4E B2RXH2 1/20 0.42
PARP1 P09874 1/20 0.42
MAPK1 P28482 1/20 0.42
HTT P42858 1/20 0.41
PLA2G7 Q13093 1/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
CYP1A2 P05177 1/20 0.41
CYP2C19 P33261 1/20 0.41
GFER P55789 1/20 0.41
RAB9A P51151 1/20 0.41
TP53 P04637 1/20 0.41
GAA P10253 1/20 0.41
THRB P10828 1/20 0.41

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
SCHEMBL4187732 0.86 KMT2A (0.54) ALDH1A1MAPTLMNAHTTSMN1; SMN2
SCHEMBL4202584 0.86 RAB9A (0.51) ALOX15ALDH1A1MAPTLMNAKDM4E
SCHEMBL4186735 0.84 ALOX15 (0.65) ALOX15LMNACYP1A2CYP2C19TP53
SCHEMBL4199011 0.84 NPC1 (0.53) ALOX15ALDH1A1MAPTLMNAKDM4E
SCHEMBL30917977 0.81 CHRM3 (0.46) ALOX15MAPTTHRB
SCHEMBL4201444 0.81 ALOX15 (0.51) ALOX15MAPTLMNAKDM4EHTT
SCHEMBL29198676 0.81 CHRM3 (0.46) ALOX15MAPTTHRB
SCHEMBL168618 0.76 MEN1 (0.63) ALDH1A1MAPTLMNAKDM4EMAPK1
SCHEMBL23992170 0.76 KDM4E (0.49) ALDH1A1LMNAKDM4EMAPK1SMN1; SMN2
SCHEMBL4205361 0.76 RAB9A (0.56) ALOX15ALDH1A1MAPTLMNAKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2609091-A1 PHARMACEUTICALLY ACTIVE COMPOUNDS AS AXL INHIBITORS Lead Discovery Center GmbH (DE) 2013-07-03 EP disclosed
WO-2012028332-A1 PHARMACEUTICALLY ACTIVE COMPOUNDS AS AXL INHIBITORS LEAD DISCOVERY CENTER GMBH (DE) 2012-03-08 WO disclosed