SCHEMBL20804682

SCHEMBL20804682

Cc1ccc2c(ccc3ccc(Cc4ccc5c(c4)sc4ccccc45)cc32)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.41
MAPT P10636 4/20 0.41
RAB9A P51151 3/20 0.41
HPGD P15428 3/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
GPR3 P46089 1/20 0.39
L3MBTL1 Q9Y468 3/20 0.38
ATM Q13315 1/20 0.38
TDP1 Q9NUW8 4/20 0.37
HSD17B10 Q99714 3/20 0.37
HIF1A Q16665 1/20 0.37
CYP1B1 Q16678 1/20 0.37
CYP1A2 P05177 3/20 0.36
CYP2A6 P11509 1/20 0.36
ROCK1 Q13464 1/20 0.36
GAA P10253 2/20 0.35
KDM4E B2RXH2 2/20 0.35
MEN1 O00255 1/20 0.35
NPC1 O15118 1/20 0.35
KMT2A Q03164 1/20 0.35

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
SCHEMBL26258291 0.85 ALDH1A1 (0.45) ALDH1A1MAPTRAB9AHPGDSMN1; SMN2
SCHEMBL24750413 0.85 MAPT (0.45) ALDH1A1MAPTRAB9AHPGDSMN1; SMN2
SCHEMBL24677507 0.85 ALDH1A1 (0.45) ALDH1A1MAPTRAB9AHPGDSMN1; SMN2
SCHEMBL19155273 0.79 ALDH1A1 (0.47) ALDH1A1MAPTRAB9AHPGDSMN1; SMN2
SCHEMBL19155362 0.77 GPR3 (0.52) ALDH1A1MAPTRAB9AHPGDSMN1; SMN2
SCHEMBL31677946 0.77 GPR3 (0.61) ALDH1A1MAPTRAB9AHPGDSMN1; SMN2
SCHEMBL808361 0.77 GPR3 (0.61) ALDH1A1MAPTRAB9AHPGDSMN1; SMN2
SCHEMBL13562196 0.76 MAPT (0.47) ALDH1A1MAPTRAB9AHPGDSMN1; SMN2
SCHEMBL27026487 0.76 MAPT (0.41) ALDH1A1MAPTRAB9AHPGDSMN1; SMN2
SCHEMBL25840138 0.76 SMN1; SMN2 (0.39) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190081251-A1 PHOTOELECTRIC CONVERSION ELEMENT AND SOLID-STATE IMAGING DEVICE SONY CORPORATION (JP) 2019-03-14 US disclosed