SCHEMBL4405529

SCHEMBL4405529

COc1ccc2ccc3c(c2c1)C1C2C=CC(C2)C1C3

nearest known ligand 0.45

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MTNR1A P48039 17/20 0.45
MTNR1B P49286 17/20 0.45
HTR2C P28335 14/20 0.45
GAA P10253 1/20 0.40
ALDH1A1 P00352 1/20 0.39

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
SCHEMBL4402560 0.91 HTR2A (0.45) MTNR1AMTNR1BHTR2CGAAALDH1A1
SCHEMBL4402553 0.85 MTNR1A (0.39) MTNR1AMTNR1BHTR2CGAAALDH1A1
SCHEMBL4403306 0.79 MTNR1A (0.40) MTNR1AMTNR1BGAA
SCHEMBL4405533 0.77 HTR2A (0.42) MTNR1AMTNR1BHTR2CGAAALDH1A1
SCHEMBL4402522 0.76 CHRNB2 (0.46) HTR2CGAAALDH1A1
SCHEMBL4408096 0.73 DPP4 (0.39) MTNR1AMTNR1BGAAALDH1A1
SCHEMBL4408093 0.73 MEN1 (0.39) MTNR1AMTNR1B
SCHEMBL4442946 0.70 CYP2A6 (0.31)
SCHEMBL4405547 0.69 MTNR1A (0.42) MTNR1AMTNR1BHTR2CGAA
SCHEMBL4405582 0.68 MTNR1A (0.39) MTNR1AMTNR1BHTR2CGAA

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-8877422-B2 Resist underlayer film composition and patterning process using the same SHIN-ETSU CHEMICAL CO., LTD. (JP) 2014-11-04 US disclosed
US-20120108071-A1 RESIST UNDERLAYER FILM COMPOSITION AND PATTERNING PROCESS USING THE SAME SHIN-ETSU CHEMICAL CO., LTD. (JP) 2012-05-03 US disclosed