SCHEMBL16751345

SCHEMBL16751345

C=C/C=C\c1c(C)ccc(=O)n1C

nearest known ligand 0.32

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ CA12 O43570 1/20 0.32
▸ BRD4 O60885 1/20 0.32
▸ BRPF1 P55201 1/20 0.32
▸ CA9 Q16790 1/20 0.32
▸ KAT2B Q92831 1/20 0.32
▸ BRD9 Q9H8M2 1/20 0.32
▸ CYP19A1 P11511 1/20 0.30
▸ NQO2 P16083 1/20 0.30
▸ KDM4E B2RXH2 1/20 0.30
▸ ALDH1A1 P00352 1/20 0.30
▸ CYP1A2 P05177 1/20 0.30
▸ HPGD P15428 1/20 0.30
▸ BLM P54132 1/20 0.30
▸ HSD17B10 Q99714 1/20 0.30

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
SCHEMBL22510139 0.72 — —
SCHEMBL14254506 0.68 BRPF1 (0.40) CA12BRD4BRPF1CA9KAT2B
SCHEMBL20117398 0.68 — —
SCHEMBL10314053 0.65 BRPF1 (0.41) CA12BRD4BRPF1CA9KAT2B
SCHEMBL19041295 0.65 — —
SCHEMBL19565002 0.65 — —
SCHEMBL22810524 0.64 — —
SCHEMBL25768644 0.64 MAPT (0.33) KDM4EALDH1A1
SCHEMBL23005829 0.63 — —
SCHEMBL17589202 0.63 BRPF1 (0.36) CA12BRD4BRPF1CA9KAT2B

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-20150144846-A1 ORGANIC SEMICONDUCTOR MERCK PATENT GMBH (DE) 2015-05-28 — — 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-20150144846-A1 ORGANIC SEMICONDUCTOR OCIAD2, OCIAD1, DDT CA12 4511/4885BRD4 2116/4885BRPF1 3027/4885

“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.

Send feedback