SCHEMBL8667014

SCHEMBL8667014

CCCCNc1cccc(NCCCC)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F2R P25116 2/20 0.56
MAPT P10636 2/20 0.54
CYP1A2 P05177 2/20 0.54
CYP3A4 P08684 2/20 0.54
CYP2C9 P11712 2/20 0.54
CYP2C19 P33261 2/20 0.54
CYP2D6 P10635 1/20 0.54
HTT P42858 1/20 0.54
ALDH1A1 P00352 3/20 0.50
ABL1 P00519 1/20 0.47
KCNH3 Q9ULD8 1/20 0.44
SMN1; SMN2 Q16637 2/20 0.44
TLR8 Q9NR97 1/20 0.42
AR P10275 1/20 0.42
GAA P10253 1/20 0.41
HPGD P15428 1/20 0.41
NR4A2 P43354 1/20 0.41
MTNR1A P48039 1/20 0.41
MTNR1B P49286 1/20 0.41
KDM4E B2RXH2 1/20 0.41

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
SCHEMBL3662823 0.93 ABL1 (0.54) F2RMAPTCYP1A2CYP3A4CYP2C9
SCHEMBL3440754 0.88 MAPT (0.74) F2RMAPTCYP1A2CYP3A4CYP2C9
SCHEMBL27642277 0.88 F2R (0.48) F2RMAPTCYP1A2CYP3A4CYP2C9
SCHEMBL31519377 0.88 MAPT (0.74) F2RMAPTCYP1A2CYP3A4CYP2C9
SCHEMBL11661296 0.86 F2R (0.54) F2RMAPTCYP1A2CYP3A4CYP2C9
SCHEMBL3224710 0.86 F2R (0.50) F2RMAPTCYP1A2CYP3A4CYP2C9
SCHEMBL8168701 0.86 F2R (0.47) F2RMAPTCYP1A2CYP3A4CYP2C9
SCHEMBL28044646 0.86 RAPGEF4 (0.47) F2RMAPTCYP1A2CYP3A4CYP2C9
SCHEMBL22176875 0.86 ABL1 (0.53) F2RMAPTCYP1A2CYP3A4CYP2C9
SCHEMBL11522061 0.86 EPHX1 (0.55) F2RMAPTCYP1A2CYP3A4CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115152037-A 2D perovskite tandem photovoltaic device 立方光伏股份有限公司 2022-10-04 CN disclosed
US-5710335-A REACTING RESORCIN WITH PRIMARY AMINE THEN ALKYL HALIDE MITSUI TOATSU CHEMICALS, INC. (JP) 1998-01-20 US disclosed
EP-0111844-B1 PROCESS FOR THE PREPARATION OF 3-ACYLAMINOANILINES HOECHST AKTIENGESELLSCHAFT (DE) 1985-11-27 EP disclosed
EP-0111844-A1 Process for the preparation of 3-acylaminoanilines HOECHST AKTIENGESELLSCHAFT (DE) 1984-06-27 EP disclosed