SCHEMBL17868873

SCHEMBL17868873

CCCCCC(CC)C1=NOc2ccccc2C1

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CYSLTR2 Q9NS75 1/20 0.33
CYSLTR1 Q9Y271 1/20 0.33
NR1I2 O75469 1/20 0.33
MAOA P21397 1/20 0.32
MAOB P27338 1/20 0.32
ALDH1A1 P00352 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2D6 P10635 1/20 0.31
CYP2C19 P33261 1/20 0.31

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
SCHEMBL253210 0.73 CYP2D6 (0.38) MAOAMAOBALDH1A1CYP1A2CYP2D6
SCHEMBL17868865 0.72 ALDH1A1 (0.35) MAOAMAOBALDH1A1
SCHEMBL2928205 0.68 ALDH1A1 (0.34) MAOAMAOBALDH1A1CYP1A2CYP2D6
SCHEMBL9052322 0.67 MAOA (0.39) MAOAMAOBALDH1A1CYP1A2CYP2D6
SCHEMBL574574 0.65 MAOA (0.48) MAOAMAOBCYP1A2
SCHEMBL22623564 0.65 NR1I2 (0.38) NR1I2
SCHEMBL8524531 0.65 NR1I2 (0.45) CYSLTR2CYSLTR1NR1I2
SCHEMBL10931533 0.65 MAOA (0.37) MAOAMAOBALDH1A1
SCHEMBL9437894 0.64 MAOA (0.36) MAOAMAOB
SCHEMBL6685367 0.64 NR1I2 (0.56) NR1I2ALDH1A1

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-9803098-B2 Conductive ink PESOLVE CO., LTD. (KR) 2017-10-31 US disclosed
US-20160185990-A1 CONDUCTIVE INK YMT CO.,LTD. (KR) 2016-06-30 US disclosed