SCHEMBL15040965

SCHEMBL15040965

c1ccc2nc(-c3ccc4c(c3)sc3ccccc34)c(-c3ccc4c(c3)sc3ccccc34)nc2c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.49
MAPT P10636 3/20 0.49
RAB9A P51151 2/20 0.49
HPGD P15428 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
GPR3 P46089 1/20 0.48
LMNA P02545 4/20 0.41
L3MBTL1 Q9Y468 3/20 0.41
KDM4E B2RXH2 3/20 0.41
TDP1 Q9NUW8 2/20 0.41
GAA P10253 2/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41
POLB P06746 1/20 0.41
THRB P10828 1/20 0.41
AKT1 P31749 1/20 0.39
AKT2 P31751 1/20 0.39
APP P05067 2/20 0.39
MAPK10 P53779 1/20 0.38
MAPK14 Q16539 1/20 0.38

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
SCHEMBL24266810 0.90 L3MBTL1 (0.44) ALDH1A1MAPTRAB9AHPGDSMN1; SMN2
SCHEMBL24266601 0.90 ALDH1A1 (0.41) ALDH1A1MAPTRAB9AHPGDSMN1; SMN2
SCHEMBL22277120 0.89 KDM4E (0.51) ALDH1A1MAPTRAB9AHPGDSMN1; SMN2
SCHEMBL24266258 0.86 ALDH1A1 (0.47) ALDH1A1MAPTRAB9AHPGDSMN1; SMN2
SCHEMBL22096973 0.85 KDM4E (0.43) ALDH1A1MAPTRAB9AHPGDSMN1; SMN2
SCHEMBL24275436 0.84 MAPT (0.36) ALDH1A1MAPTRAB9AHPGDSMN1; SMN2
SCHEMBL24275122 0.84 MAPT (0.36) ALDH1A1MAPTRAB9AHPGDSMN1; SMN2
SCHEMBL24266908 0.84 ALDH1A1 (0.45) ALDH1A1MAPTRAB9AHPGDSMN1; SMN2
SCHEMBL22880551 0.82 L3MBTL1 (0.43) ALDH1A1MAPTRAB9AHPGDSMN1; SMN2
SCHEMBL22880226 0.82 L3MBTL1 (0.43) ALDH1A1MAPTRAB9AHPGDSMN1; 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140358198-A1 ORGANIC SENSITIZERS FOR UP-CONVERSION MERCK PATENT GMBH (DE) 2014-12-04 US disclosed
US-20140358198-A1 ORGANIC SENSITIZERS FOR UP-CONVERSION MERCK PATENT GMBH (DE) 2014-12-04 US disclosed