SCHEMBL2312427

SCHEMBL2312427

OCCc1cccc2cc3c(CCO)cccc3cc12

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 14/20 0.40
MTNR1B P49286 9/20 0.40
HTR2A P28223 1/20 0.38
NQO2 P16083 5/20 0.37
HTR2C P28335 1/20 0.36
HTR2B P41595 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
ALDH1A1 P00352 1/20 0.36
HIF1A Q16665 1/20 0.36
CYP1B1 Q16678 1/20 0.36
HSD17B10 Q99714 1/20 0.36

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
SCHEMBL1456304 0.94 ALDH1A1 (0.43) MTNR1AMTNR1BHTR2ANQO2HTR2C
SCHEMBL2312110 0.93 MTNR1A (0.39) MTNR1AMTNR1BHTR2ANQO2HTR2C
SCHEMBL2306866 0.92 KDM4E (0.42) MTNR1AMTNR1BHTR2ANQO2HTR2C
SCHEMBL2310265 0.89 ALDH1A1 (0.57) MTNR1AMTNR1BHTR2ANQO2TDP1
SCHEMBL15921658 0.89 ALDH1A1 (0.42) MTNR1AMTNR1BHTR2ANQO2HTR2C
SCHEMBL2312805 0.86 CYP1A2 (0.42) MTNR1AMTNR1BHTR2ANQO2HTR2C
SCHEMBL2310497 0.84 SOX18 (0.40) MTNR1AMTNR1BHTR2AHTR2CHTR2B
SCHEMBL2307599 0.84 SOX18 (0.40) MTNR1AMTNR1BHTR2AHTR2CHTR2B
SCHEMBL2310413 0.83 L3MBTL1 (0.40) MTNR1AHTR2ATDP1ALDH1A1HIF1A
SCHEMBL2308132 0.83 CYP1A2 (0.51) MTNR1AMTNR1BHTR2ANQO2TDP1

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-7989517-B2 Actinic ray curable composition, actinic ray curable ink, and image formation process employing the same KONICA MINOLTA MEDICAL & GRAPHIC, INC. (JP) 2011-08-02 US disclosed
US-20070123600-A1 ACTINIC RAY CURABLE COMPOSITION, ACTINIC RAY CURABLE INK, AND IMAGE FORMATION PROCESS EMPLOYING THE SAME KONICA MINOLTA MEDICAL & GRAPHIC, INC. (JP) 2007-05-31 US disclosed