SCHEMBL11099219

SCHEMBL11099219

CCCCCCCCCCNC(=O)C=Cc1cccc(N)c1

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 1/20 0.71
▸ APP P05067 1/20 0.63
▸ HTR1A P08908 2/20 0.56
▸ HTR2C P28335 2/20 0.56
▸ HTR2A P28223 1/20 0.56
▸ SLC6A4 P31645 1/20 0.56
▸ HTR7 P34969 1/20 0.56
▸ HTR6 P50406 1/20 0.56
▸ HPGD P15428 2/20 0.55
▸ CYP1A2 P05177 1/20 0.55
▸ CYP2C19 P33261 1/20 0.55
▸ KMT2A Q03164 1/20 0.54
▸ PYGL P06737 5/20 0.53
▸ NPSR1 Q6W5P4 1/20 0.51
▸ HDAC3 O15379 1/20 0.51
▸ HDAC4 P56524 1/20 0.51
▸ HDAC1 Q13547 1/20 0.51
▸ HDAC7 Q8WUI4 1/20 0.51
▸ HDAC2 Q92769 1/20 0.51
▸ HDAC10 Q969S8 1/20 0.51

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
SCHEMBL11099216 1.00 EGFR (0.71) EGFRAPPHTR1AHTR2CHTR2A
SCHEMBL8757222 0.86 EGFR (0.73) EGFRAPPHTR1AHTR2CHTR2A
SCHEMBL8756520 0.86 EGFR (0.73) EGFRAPPHTR1AHTR2CHTR2A
SCHEMBL8757218 0.86 EGFR (0.73) EGFRAPPHTR1AHTR2CHTR2A
SCHEMBL8756511 0.86 EGFR (0.73) EGFRAPPHTR1AHTR2CHTR2A
SCHEMBL8757229 0.86 EGFR (0.73) EGFRAPPHTR1AHTR2CHTR2A
SCHEMBL8756506 0.86 EGFR (0.73) EGFRAPPHTR1AHTR2CHTR2A
N-Dodecylcinnamamide SCHEMBL16596238 0.84 EGFR (1.00) EGFRAPPHTR1AHTR2CHTR2A
N-Dodecylcinnamamide SCHEMBL28975087 0.84 EGFR (1.00) EGFRAPPHTR1AHTR2CHTR2A
N-Octylcinnamamide SCHEMBL10706126 0.84 EGFR (1.00) EGFRAPPHTR1AHTR2CHTR2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0047119-B1 CARBOXAMIDE COMPOUNDS AS SRS-A ANTAGONISTS, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM, PROCESSES FOR THE PREPARATION, AND INTERMEDIATES USEFUL THEREIN PFIZER INC. (US) 1984-05-09 — — EP disclosed
EP-0050977-B1 CARBOXAMIDE COMPOUNDS AS SRS-A ANTAGONISTS AND A PROCESS FOR PRODUCING SAME PFIZER INC. (US) 1983-09-14 — — EP disclosed
US-4343813-A ANTIANAPHYLACTIC AGENTS PFIZER INC. (US) 1982-08-10 — — US disclosed
US-4331683-A SENSITIZATION, ANTIALLERGENS PFIZER INC. (US) 1982-05-25 — — US disclosed
EP-0050977-A1 Carboxamide compounds as SRS-A antagonists and a process for producing same PFIZER INC. (US) 1982-05-05 — — EP disclosed
EP-0047119-A1 Carboxamide compounds as SRS-A antagonists, pharmaceutical compositions containing them, processes for the preparation, and intermediates useful therein PFIZER INC. (US) 1982-03-10 — — EP disclosed
US-4296120-A ANTIANAPHYLACTIC PFIZER INC. (US) 1981-10-20 — — US disclosed
US-4296129-A ANTIAASTHMATIC INHIBITOR OF SLOW-REACTING SUBSTANCE OF ANAPHYLAXIS PFIZER, INC. (US) 1981-10-20 — — US disclosed
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