SCHEMBL9618283

SCHEMBL9618283

CCCOc1cc(Cl)c(Br)cc1C1COC(c2c(F)cccc2Cl)=N1

nearest known ligand 0.37

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TAAR1 Q96RJ0 2/20 0.35
CYP2D6 P10635 1/20 0.35

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
SCHEMBL9306512 0.82 TAAR1 (0.44) TAAR1CYP2D6
SCHEMBL7091836 0.71 ALDH1A1 (0.38) TAAR1
SCHEMBL15693450 0.70 TAAR1 (0.41) TAAR1CYP2D6
SCHEMBL8662384 0.69 TAAR1 (0.38) TAAR1CYP2D6
SCHEMBL7515974 0.69 TAAR1 (0.36) TAAR1CYP2D6
Etoxazole SCHEMBL29376426 0.68 TAAR1 (0.36) TAAR1CYP2D6
Etoxazole SCHEMBL27300 0.68 TAAR1 (0.36) TAAR1CYP2D6
Etoxazole SCHEMBL29763628 0.68 TAAR1 (0.36) TAAR1CYP2D6
SCHEMBL6254533 0.67 NOS3 (0.38) TAAR1CYP2D6
SCHEMBL16116997 0.67 TAAR1 (0.36) TAAR1CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-4089484-A None JP disclosed
JP-H0489484-A OXAZOLINE DERIVATIVE AND INSECTICIDE AND ACARICIDE CONTAINING THE SAME YASHIMA CHEM IND CO LTD 1992-03-23 JP disclosed