SCHEMBL11877451

SCHEMBL11877451

COc1ccc(/C=C/C=C/c2cc(OC)ccc2OC)cc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A1 P04798 10/20 0.67
CYP1B1 Q16678 10/20 0.67
CYP1A2 P05177 9/20 0.67
NFE2L2 Q16236 3/20 0.67
CYP19A1 P11511 2/20 0.67
TUBB4A P04350 3/20 0.59
TUBB P07437 3/20 0.59
TUBA3C P0DPH7 3/20 0.59
TUBA1B P68363 3/20 0.59
TUBA4A P68366 3/20 0.59
TUBB4B P68371 3/20 0.59
TUBB3 Q13509 3/20 0.59
TUBB2A Q13885 3/20 0.59
TUBB8 Q3ZCM7 3/20 0.59
TUBA3E Q6PEY2 3/20 0.59
TUBA1A Q71U36 3/20 0.59
TUBA1C Q9BQE3 3/20 0.59
TUBB6 Q9BUF5 3/20 0.59
TUBB2B Q9BVA1 3/20 0.59
TUBB1 Q9H4B7 3/20 0.59

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
SCHEMBL11877456 1.00 CYP1A1 (0.67) CYP1A1CYP1B1CYP1A2NFE2L2CYP19A1
SCHEMBL11877532 0.98 NFE2L2 (0.65) CYP1A1CYP1B1CYP1A2NFE2L2CYP19A1
SCHEMBL11877320 0.98 NFE2L2 (0.65) CYP1A1CYP1B1CYP1A2NFE2L2CYP19A1
SCHEMBL11877533 0.98 NFE2L2 (0.65) CYP1A1CYP1B1CYP1A2NFE2L2CYP19A1
SCHEMBL11877637 0.98 NFE2L2 (0.65) CYP1A1CYP1B1CYP1A2NFE2L2CYP19A1
SCHEMBL11877642 0.98 NFE2L2 (0.65) CYP1A1CYP1B1CYP1A2NFE2L2CYP19A1
SCHEMBL11877327 0.98 NFE2L2 (0.65) CYP1A1CYP1B1CYP1A2NFE2L2CYP19A1
SCHEMBL11874684 0.91 CYP1A1 (0.79) CYP1A1CYP1B1CYP1A2NFE2L2CYP19A1
SCHEMBL11874692 0.91 CYP1A1 (0.79) CYP1A1CYP1B1CYP1A2NFE2L2CYP19A1
SCHEMBL11871814 0.90 CYP1A1 (0.67) CYP1A1CYP1B1CYP1A2NFE2L2CYP19A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-3947337-A α,ω-Diarylpolyene photosensitizers for sulfonylazide polymers THE UPJOHN COMPANY (US) 1976-03-30 US disclosed