SCHEMBL28848906

SCHEMBL28848906

CC(C)CCCCCc1ccccn1.CCCCCCCCc1ccccn1

nearest known ligand 0.56

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HRH1 P35367 2/20 0.54
KCNH2 Q12809 1/20 0.50
CYP1A2 P05177 3/20 0.49
ALDH1A1 P00352 2/20 0.49
CYP2C19 P33261 2/20 0.49
NAAA Q02083 1/20 0.47
HRH3 Q9Y5N1 2/20 0.44
LMNA P02545 1/20 0.42
TAAR1 Q96RJ0 1/20 0.42
ALOX15 P16050 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.41
CYP19A1 P11511 4/20 0.40
KDM4E B2RXH2 1/20 0.40
TSHR P16473 1/20 0.40
HRH4 Q9H3N8 1/20 0.40

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
SCHEMBL28848888 1.00 HRH1 (0.54) HRH1KCNH2CYP1A2ALDH1A1CYP2C19
SCHEMBL16181057 0.92 HRH1 (0.58) HRH1CYP1A2ALDH1A1CYP2C19NAAA
SCHEMBL9572197 0.88 HRH1 (0.67) HRH1KCNH2CYP1A2ALDH1A1CYP2C19
SCHEMBL919951 0.88 HRH1 (0.67) HRH1KCNH2CYP1A2ALDH1A1CYP2C19
SCHEMBL5138374 0.88 HRH1 (0.67) HRH1KCNH2CYP1A2ALDH1A1CYP2C19
SCHEMBL25380743 0.88 HRH1 (0.67) HRH1KCNH2CYP1A2ALDH1A1CYP2C19
SCHEMBL9108224 0.88 HRH1 (0.67) HRH1KCNH2CYP1A2ALDH1A1CYP2C19
SCHEMBL666135 0.88 HRH1 (0.67) HRH1KCNH2CYP1A2ALDH1A1CYP2C19
SCHEMBL21511268 0.88 HRH1 (0.67) HRH1KCNH2CYP1A2ALDH1A1CYP2C19
SCHEMBL25381489 0.88 HRH1 (0.67) HRH1KCNH2CYP1A2ALDH1A1CYP2C19

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
CN-114967332-A Colored photosensitive composition, color filter and image display device comprising the same 东友精细化工有限公司 2022-08-30 CN disclosed