SCHEMBL9700913

SCHEMBL9700913

Fc1ccc(-c2ccc(-c3cn4nccnc4n3)cc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 11/20 0.51
NPC1 O15118 9/20 0.51
KMT2A Q03164 3/20 0.45
SMN1; SMN2 Q16637 3/20 0.45
MEN1 O00255 2/20 0.45
ALDH1A3 P47895 2/20 0.44
KDM4E B2RXH2 8/20 0.41
ALDH1A1 P00352 8/20 0.41
GAA P10253 5/20 0.41
MAPT P10636 4/20 0.41
HPGD P15428 3/20 0.41
HSD17B10 Q99714 3/20 0.41
GLA P06280 3/20 0.41
TP53 P04637 2/20 0.41
GRM5 P41594 1/20 0.41
F2RL3 Q96RI0 1/20 0.40
NPSR1 Q6W5P4 2/20 0.40
NFKB1 P19838 1/20 0.40
NFKB2 Q00653 1/20 0.40
RELA Q04206 1/20 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
SCHEMBL9702278 0.98 RAB9A (0.53) RAB9ANPC1KMT2ASMN1; SMN2MEN1
SCHEMBL10797169 0.83 RAB9A (0.64) RAB9ANPC1KMT2ASMN1; SMN2MEN1
SCHEMBL17750392 0.82 RAB9A (0.60) RAB9ANPC1KMT2ASMN1; SMN2MEN1
SCHEMBL9701997 0.82 RAB9A (0.60) RAB9ANPC1KMT2ASMN1; SMN2MEN1
SCHEMBL23458469 0.81 RAB9A (0.49) RAB9ANPC1KMT2ASMN1; SMN2MEN1
SCHEMBL10803663 0.78 APP (0.51) RAB9ANPC1KMT2ASMN1; SMN2MEN1
SCHEMBL9298339 0.74 ALDH1A1 (0.73) RAB9ANPC1KMT2ASMN1; SMN2MEN1
SCHEMBL15473569 0.73 NPC1 (0.57) RAB9ANPC1ALDH1A3KDM4EALDH1A1
SCHEMBL9702800 0.72 KDM4E (0.62) KDM4EALDH1A1HPGDHSD17B10TP53
SCHEMBL18341919 0.70 RAB9A (0.43) RAB9ANPC1KMT2ASMN1; SMN2MEN1

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
WO-1992012154-A1 IMIDAZOTRIAZINE DERIVATIVES FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1992-07-23 WO disclosed