SCHEMBL14960843

SCHEMBL14960843

Cc1cc(-c2scc3ccccc23)sc1-c1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HSD17B1 P14061 1/20 0.42
▸ HSD17B2 P37059 1/20 0.42
▸ ESR1 P03372 1/20 0.41
▸ ESR2 Q92731 1/20 0.41
▸ HPGD P15428 4/20 0.39
▸ MAPT P10636 4/20 0.39
▸ NPC1 O15118 3/20 0.39
▸ HSD17B10 Q99714 2/20 0.39
▸ SMN1; SMN2 Q16637 2/20 0.39
▸ KDM4E B2RXH2 1/20 0.39
▸ HTT P42858 1/20 0.39
▸ ALDH1A1 P00352 4/20 0.35
▸ CYP2A6 P11509 2/20 0.35
▸ ALOX5 P09917 1/20 0.35
▸ MEN1 O00255 2/20 0.35
▸ LMNA P02545 2/20 0.35
▸ KMT2A Q03164 2/20 0.35
▸ MAPK1 P28482 1/20 0.35
▸ CYP1A1 P04798 1/20 0.33
▸ CYP1B1 Q16678 1/20 0.33

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
SCHEMBL18160955 0.78 ALDH1A1 (0.38) HPGDMAPTNPC1HSD17B10SMN1; SMN2
SCHEMBL20248885 0.77 CYP1A1 (0.40) ESR1ESR2HPGDMAPTSMN1; SMN2
SCHEMBL10205948 0.76 ESR1 (0.66) HSD17B1HSD17B2ESR1ESR2HPGD
SCHEMBL14960823 0.76 HSD17B1 (0.42) HSD17B1HSD17B2HPGDNPC1KDM4E
SCHEMBL14960836 0.74 HSD17B1 (0.46) HSD17B1HSD17B2ESR1ESR2HPGD
SCHEMBL23029706 0.72 SREBF2 (0.42) HPGDMAPTNPC1HSD17B10SMN1; SMN2
SCHEMBL13707358 0.71 ALDH1A1 (0.33) MAPTNPC1HSD17B10KDM4EALDH1A1
SCHEMBL20248883 0.71 CYP1A1 (0.35) ESR1ESR2CYP1A1CYP1B1
SCHEMBL18390779 0.70 HSD17B1 (0.61) HSD17B1HSD17B2ESR1ESR2HPGD
SCHEMBL23263985 0.70 HPRT1 (0.33) HPGDMAPTSMN1; SMN2ALDH1A1RAB9A

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-20130125987-A1 PHOTOELECTRIC CONVERSION ELEMENT AND SOLAR BATTERY CONTAINING THE SAME KONICA MINOLTA BUSINESS TECHNOLOGIES, INC. (JP) 2013-05-23 — — US disclosed
US-20130125987-A1 PHOTOELECTRIC CONVERSION ELEMENT AND SOLAR BATTERY CONTAINING THE SAME KONICA MINOLTA BUSINESS TECHNOLOGIES, INC. (JP) 2013-05-23 — — US disclosed
Send feedback