SCHEMBL25501915

SCHEMBL25501915

Cc1ccc(/C(=C2\CCCNC2)c2ccccc2)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 1/20 0.42
OPRD1 P41143 1/20 0.42
OPRK1 P41145 1/20 0.42
CES2 O00748 1/20 0.41
CES1 P23141 1/20 0.41
LMNA P02545 2/20 0.40
KCNH2 Q12809 2/20 0.40
CYP2D6 P10635 2/20 0.40
SETD7 Q8WTS6 1/20 0.40
CHRM2 P08172 1/20 0.40
CHRM1 P11229 1/20 0.40
CHRM3 P20309 1/20 0.40
HTR2A P28223 1/20 0.40
HRH1 P35367 1/20 0.40
HTR2B P41595 1/20 0.40
CHRNA4 P43681 1/20 0.40
HTR3A P46098 1/20 0.40
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
NPC1 O15118 1/20 0.38

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
SCHEMBL23848294 0.90 SETD7 (0.43) OPRM1OPRD1OPRK1LMNAKCNH2
Hydrochloric Acid SCHEMBL8983767 0.89 SETD7 (0.42) OPRM1OPRD1OPRK1LMNAKCNH2
SCHEMBL3662534 0.81 CYP1A1 (0.41) OPRM1OPRD1OPRK1CES2CES1
SCHEMBL23848519 0.81 CYP1A1 (0.41) OPRM1OPRD1OPRK1CES2CES1
SCHEMBL3662531 0.81 CYP1A1 (0.41) OPRM1OPRD1OPRK1CES2CES1
SCHEMBL8316576 0.80 OPRD1 (0.60) OPRM1OPRD1OPRK1CES2CES1
SCHEMBL8313311 0.79 OPRM1 (0.50) OPRM1OPRD1OPRK1LMNAKCNH2
SCHEMBL3662643 0.77 OPRM1 (0.44) OPRM1OPRD1OPRK1LMNAKCNH2
SCHEMBL3662638 0.77 OPRM1 (0.44) OPRM1OPRD1OPRK1LMNAKCNH2
SCHEMBL23832799 0.77 OPRD1 (0.44) OPRM1OPRD1CES2CES1KCNH2

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-20230146127-A1 3-DIARYLMETHYLENES AND USES THEREOF ATUX ISKAY LLC 2023-05-11 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20230146127-A1 3-DIARYLMETHYLENES AND USES THEREOF MYC, MYCBP, FOXO1 OPRM1 4274/4885OPRD1 3701/4885OPRK1 3381/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.