SCHEMBL9635308

SCHEMBL9635308

CCCCCCCCN(CCCCCCCC)Cn1cncn1

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 7/20 0.36
DNM1 Q05193 3/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
TLR8 Q9NR97 1/20 0.33
TLR7 Q9NYK1 1/20 0.33
TBXAS1 P24557 1/20 0.33
EGLN3 Q9H6Z9 1/20 0.33
CYP19A1 P11511 1/20 0.33

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
SCHEMBL19347168 1.00 KCNH2 (0.36) KCNH2DNM1CYP1A2CYP2D6CYP2C9
SCHEMBL19347160 1.00 KCNH2 (0.36) KCNH2DNM1CYP1A2CYP2D6CYP2C9
SCHEMBL19347165 1.00 KCNH2 (0.36) KCNH2DNM1CYP1A2CYP2D6CYP2C9
SCHEMBL19347170 0.98 CYP1A2 (0.34) KCNH2DNM1CYP1A2CYP2D6CYP2C9
SCHEMBL10834083 0.97 KCNH2 (0.36) KCNH2DNM1CYP1A2CYP2D6CYP2C9
SCHEMBL19347156 0.93 CYP1A2 (0.35) CYP1A2CYP2D6CYP2C9CYP2C19TLR8
SCHEMBL19347162 0.85 CYP19A1 (0.36) CYP1A2CYP2D6CYP2C9CYP2C19EGLN3
SCHEMBL2315353 0.82 MEN1 (0.33) EGLN3CYP19A1
SCHEMBL11479558 0.76 TBXAS1 (0.46) TLR8TLR7TBXAS1EGLN3
SCHEMBL11474954 0.76 TBXAS1 (0.46) TLR8TLR7TBXAS1EGLN3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2024150450-A1 COMPOSITION FOR ELECTRODE FORMATION, ADDITIVE, AND GELATION INHIBITOR 日産化学株式会社 2024-07-18 WO disclosed
WO-2024150812-A1 COMPOSITION FOR ELECTRODE FORMATION, ADDITIVE, AND GELATION INHIBITOR 日産化学株式会社 2024-07-18 WO disclosed
WO-2024150479-A1 COMPOSITION FOR ELECTRODE FORMATION, ADDITIVE, AND GELATION INHIBITOR 日産化学株式会社 2024-07-18 WO disclosed
US-9765276-B2 Additive for lubricant compositions comprising a sulfur-containing and a sulfur-free organomolybdenum compound, and a triazole or a derivatized triazole VANDERBILT CHEMICALS, LLC (US) 2017-09-19 US disclosed
US-5118702-A FUNGICIDAL AND MICROBICIDAL SUBSTITUTED 1-AMINOMETHYL-3-ARYL-4-CYANO-PYRROLES BAYER AKTIENGESELLSCHAFT (DE) 1992-06-02 US disclosed
EP-0435043-A1 Substituted 1-aminomethyl-3-aryl-4-cyano-pyrroles BAYER AG (DE) 1991-07-03 EP disclosed
US-4599427-A FUNGICIDES BACTERICIDES SLIMICIDES ALGICIDES BAYER AKTIENGESELLSCHAFT (DE) 1986-07-08 US disclosed
EP-0106243-B1 AZOLYL-METHYL AMINES, THEIR PREPARATION AND THEIR USE IN MICROBICIDE COMPOSITIONS BAYER AG (DE) 1986-05-28 EP disclosed
EP-0106243-A1 Azolyl-methyl amines, their preparation and their use in microbicide compositions BAYER AG (DE) 1984-04-25 EP disclosed