SCHEMBL10697035

SCHEMBL10697035

CN(C)c1ccc(-c2ncc(-c3ccccc3F)o2)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 11/20 0.64
NPC1 O15118 10/20 0.64
RXFP1 Q9HBX9 2/20 0.64
ALOX15 P16050 1/20 0.47
TSHR P16473 1/20 0.47
CASP1 P29466 1/20 0.47
KMT2A Q03164 6/20 0.42
MEN1 O00255 4/20 0.42
MITF O75030 1/20 0.42
KDM4E B2RXH2 9/20 0.42
ALDH1A1 P00352 9/20 0.42
LMNA P02545 2/20 0.41
HPGD P15428 6/20 0.41
MAPT P10636 5/20 0.41
GAA P10253 5/20 0.41
TP53 P04637 4/20 0.41
SMN1; SMN2 Q16637 4/20 0.41
GLA P06280 2/20 0.41
MAPK1 P28482 1/20 0.41
TDP1 Q9NUW8 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
SCHEMBL1809702 0.81 ALOX15 (0.74) RAB9ANPC1RXFP1ALOX15TSHR
SCHEMBL4879301 0.81 ALOX15 (0.74) RAB9ANPC1RXFP1ALOX15TSHR
SCHEMBL8553446 0.80 ALOX15 (0.46) RAB9ANPC1RXFP1ALOX15TSHR
SCHEMBL28293705 0.78 KDM4E (0.57) RAB9ANPC1ALOX15TSHRCASP1
SCHEMBL12171394 0.77 RAB9A (0.56) RAB9ANPC1ALOX15TSHRCASP1
SCHEMBL14140425 0.75 ALOX15 (0.54) RAB9ANPC1RXFP1ALOX15TSHR
SCHEMBL13600370 0.75 RAB9A (0.67) RAB9ANPC1ALOX15TSHRCASP1
SCHEMBL14926260 0.74 NPC1 (0.49) RAB9ANPC1RXFP1ALOX15TSHR
SCHEMBL8319400 0.74 NPC1 (0.63) RAB9ANPC1RXFP1KMT2AMEN1
SCHEMBL12573259 0.74 HSD17B1 (0.57) RAB9ANPC1ALOX15TSHRCASP1

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-0277039-A2 Electrophotograhic plate by use of metal naphthalocyanine derivative Hitachi Chemical Co., Ltd. (JP) 1988-08-03 EP disclosed