SCHEMBL23861629

SCHEMBL23861629

Oc1ccc2c(C(c3ccccc3)(c3ccccc3)c3c(O)ccc4cc(O)ccc34)c(O)ccc2c1

nearest known ligand 0.46

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ ESR2 Q92731 8/20 0.46
▸ ESR1 P03372 7/20 0.46
▸ CYP1A2 P05177 3/20 0.45
▸ HSD17B1 P14061 3/20 0.45
▸ HSD17B2 P37059 3/20 0.45
▸ CYP3A4 P08684 2/20 0.45
▸ CYP2D6 P10635 2/20 0.45
▸ CYP2C9 P11712 2/20 0.45
▸ CYP2B6 P20813 2/20 0.45
▸ CYP2C19 P33261 2/20 0.45
▸ NQO2 P16083 1/20 0.39
▸ MPL P40238 1/20 0.39
▸ TLR8 Q9NR97 1/20 0.38
▸ MEN1 O00255 1/20 0.37
▸ NPC1 O15118 1/20 0.37
▸ RAB9A P51151 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ CDK4 P11802 1/20 0.36
▸ CCND1 P24385 1/20 0.36

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
SCHEMBL23861408 0.89 ERN1 (0.44) ESR2ESR1CYP1A2HSD17B1HSD17B2
SCHEMBL23861481 0.88 ESR1 (0.41) ESR2ESR1CYP1A2HSD17B1HSD17B2
SCHEMBL23861442 0.84 ESR2 (0.49) ESR2ESR1CYP1A2HSD17B1HSD17B2
SCHEMBL23861627 0.82 PTPN22 (0.50) CYP1A2CYP2D6CYP2C9CYP2C19MEN1
SCHEMBL23861480 0.81 CYP1A2 (0.35) ESR2ESR1CYP1A2HSD17B1HSD17B2
SCHEMBL23861405 0.78 MEN1 (0.43) MPLMEN1NPC1RAB9AKMT2A
SCHEMBL23082053 0.76 ESR1 (0.54) ESR2ESR1CYP1A2HSD17B1HSD17B2
SCHEMBL19063578 0.75 HSD17B1 (0.56) ESR2ESR1CYP1A2HSD17B1HSD17B2
SCHEMBL23861459 0.75 CYP2C9 (0.44) ESR2ESR1CYP1A2HSD17B1HSD17B2
SCHEMBL23861565 0.75 ESR1 (0.40) ESR2ESR1CYP1A2HSD17B1HSD17B2

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-11130724-B2 Compound, resin, composition, resist pattern formation method, and circuit pattern formation method MITSUBISHI GAS CHEMICAL COMPANY, INC. (JP) 2021-09-28 — — 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-11130724-B2 Compound, resin, composition, resist pattern formation method, and circuit pattern formation method RER1, NBAS, INTS9 ESR2 1033/4885ESR1 713/4885CYP1A2 2085/4885

“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.

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