SCHEMBL8701907

SCHEMBL8701907

ClCCCCCc1ccccn1

nearest known ligand 0.69

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HRH1 P35367 2/20 0.69
NAAA Q02083 1/20 0.57
CYP1A2 P05177 4/20 0.50
HRH3 Q9Y5N1 3/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
CYP2C19 P33261 2/20 0.50
HRH4 Q9H3N8 2/20 0.49
ALDH1A1 P00352 2/20 0.48
LMNA P02545 1/20 0.48
TAAR1 Q96RJ0 1/20 0.48
ALOX15 P16050 1/20 0.48
CHRM2 P08172 1/20 0.47
CYP2D6 P10635 1/20 0.46
MAPT P10636 1/20 0.44
LIN28A Q9H9Z2 1/20 0.44
TDP1 Q9NUW8 1/20 0.44

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
SCHEMBL28529895 1.00 HRH1 (0.69) HRH1NAAACYP1A2HRH3SMN1; SMN2
SCHEMBL29145039 1.00 HRH1 (0.69) HRH1NAAACYP1A2HRH3SMN1; SMN2
SCHEMBL28342947 1.00 HRH1 (0.69) HRH1NAAACYP1A2HRH3SMN1; SMN2
SCHEMBL28446806 1.00 HRH1 (0.69) HRH1NAAACYP1A2HRH3SMN1; SMN2
SCHEMBL31591272 1.00 HRH1 (0.69) HRH1NAAACYP1A2HRH3SMN1; SMN2
SCHEMBL28566857 1.00 HRH1 (0.69) HRH1NAAACYP1A2HRH3SMN1; SMN2
Water SCHEMBL28352691 0.98 HRH1 (0.67) HRH1NAAACYP1A2HRH3SMN1; SMN2
SCHEMBL26416035 0.98 HRH1 (0.66) HRH1NAAACYP1A2HRH3SMN1; SMN2
Hydrochloric Acid SCHEMBL28007909 0.96 HRH1 (0.63) HRH1NAAACYP1A2HRH3SMN1; SMN2
SCHEMBL3046123 0.91 HRH1 (0.62) HRH1NAAACYP1A2HRH3SMN1; SMN2

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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116946989-A Preparation method of phosphane/deuterated phosphane and derivatives thereof 北京大学 2023-10-27 CN disclosed
US-5773469-A Diaryl antimicrobial agents ORTHO PHARMACEUTICAL CORPORATION (US) 1998-06-30 US disclosed
WO-1997048674-A1 DIARYL ANTIMICROBIAL AGENTS ORTHO PHARMACEUTICAL CORPORATION (US) 1997-12-24 WO disclosed
EP-0299379-B1 PENTADIENAMIDE PAF-ANTAGONISTS F. HOFFMANN-LA ROCHE AG (CH) 1993-04-21 EP disclosed
US-4975438-A ANTICOAGULANT HOFFMANN-LA ROCHE INC. (US) 1990-12-04 US disclosed
US-4927838-A CARDIOVASCULAR DISORDERS HOFFMAN-LA ROCHE INC. (US) 1990-05-22 US disclosed
US-4927826-A Cycloproylpropenamides useful as platelet activing factor (PAF) antagonists HOFFMAN-LA ROCHE INC. (US) 1990-05-22 US disclosed
US-4916145-A PLATELET ACTIVATING FACTOR ANTAGONISTS HOFFMANN-LA ROCHE INC. (US) 1990-04-10 US disclosed
EP-0299379-A1 Pentadienamide PAF-antagonists F. HOFFMANN-LA ROCHE AG (CH) 1989-01-18 EP disclosed
US-4788206-A CARDIOVASCULAR DISORDERS, PLATELETS HOFFMANN-LA ROCHE INC. (US) 1988-11-29 US disclosed
US-4786646-A PLATELET ACTIVATING FACTOR ANTAGONISTS HOFFMANN-LA ROCHE INC. (US) 1988-11-22 US disclosed