SCHEMBL25501701

SCHEMBL25501701

CC(C)=C1c2ccc(C)cc2CCc2cc(F)ccc21

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
CYP11B1 P15538 8/20 0.42
SRD5A1 P18405 3/20 0.39
PARP10 Q53GL7 1/20 0.39
PARP11 Q9NR21 1/20 0.39
CYP19A1 P11511 8/20 0.38
CYP11B2 P19099 7/20 0.38
NOTUM Q6P988 2/20 0.36
PTAFR P25105 2/20 0.36
DHODH Q02127 1/20 0.35
ACHE P22303 2/20 0.34

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
SCHEMBL7665011 0.86 PARP10 (0.46) CYP11B1SRD5A1PARP10PARP11CYP19A1
SCHEMBL25501699 0.79 ACHE (0.39) ACHE
SCHEMBL24727675 0.74 PGR (0.49) PARP10PARP11ACHE
SCHEMBL19422232 0.73 PARP10 (0.55) SRD5A1PARP10PARP11CYP19A1CYP11B2
SCHEMBL10044943 0.72 CA9 (0.42) ACHE
SCHEMBL13218782 0.69 PARP10 (0.44) SRD5A1PARP10PARP11CYP19A1CYP11B2
SCHEMBL20014806 0.69 SLC6A2 (0.43) SRD5A1ACHE
SCHEMBL803069 0.67 MIF (0.54) SRD5A1PARP10PARP11ACHE
SCHEMBL23474573 0.67 CYP11B1 (0.39) CYP11B1SRD5A1CYP19A1CYP11B2NOTUM
SCHEMBL13849161 0.66 CYP11B2 (0.46) CYP11B1SRD5A1PARP10CYP19A1CYP11B2

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 CYP11B1 1875/4885SRD5A1 2692/4885PARP10 1281/4885

“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.