SCHEMBL19202200

SCHEMBL19202200

Cc1ccc2cc(O)c(O)c(O)c2c1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TRPA1 O75762 2/20 0.44
▸ CYP1A2 P05177 5/20 0.44
▸ CYP2A6 P11509 4/20 0.44
▸ DAO P14920 2/20 0.43
▸ TP53 P04637 2/20 0.43
▸ TDP1 Q9NUW8 2/20 0.43
▸ DDO Q99489 1/20 0.43
▸ SELL P14151 1/20 0.42
▸ SELP P16109 1/20 0.42
▸ SELE P16581 1/20 0.42
▸ HSD17B10 Q99714 3/20 0.40
▸ ALDH1A1 P00352 2/20 0.40
▸ ALOX15 P16050 2/20 0.40
▸ LMNA P02545 3/20 0.39
▸ GAA P10253 2/20 0.39
▸ HPGD P15428 2/20 0.39
▸ KDM4E B2RXH2 1/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ ALOX12 P18054 1/20 0.39

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
SCHEMBL8340063 0.85 TRPA1 (0.43) TRPA1CYP1A2CYP2A6DAOTP53
SCHEMBL6355043 0.83 TRPA1 (0.44) TRPA1CYP1A2CYP2A6DAOTP53
SCHEMBL5676618 0.80 TRPA1 (0.52) TRPA1CYP1A2CYP2A6DAOTP53
SCHEMBL30159693 0.80 TRPA1 (0.52) TRPA1CYP1A2CYP2A6DAOTP53
SCHEMBL28664564 0.80 TRPA1 (0.52) TRPA1CYP1A2CYP2A6DAOTP53
SCHEMBL15847007 0.78 TRPM4 (0.45) TRPA1CYP1A2CYP2A6DAOTP53
SCHEMBL19202403 0.77 LDHA (0.54) CYP1A2DAODDOHSD17B10ALDH1A1
SCHEMBL19202406 0.77 LDHA (0.58) CYP1A2DAODDOHSD17B10ALDH1A1
SCHEMBL29291168 0.77 CYP2A6 (0.45) TRPA1CYP1A2CYP2A6TP53TDP1
SCHEMBL21920117 0.77 CYP1A2 (0.48) TRPA1CYP1A2CYP2A6TP53TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170217999-A1 SURFACE PRIMER COMPOSITIONS AND METHODS OF USE ORMCO CORPORATION 2017-08-03 — — US disclosed
WO-2017132463-A1 SURFACE PRIMER COMPOSITIONS AND METHODS OF USE ACatechol, Inc. (US) 2017-08-03 — — WO 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-20170217999-A1 SURFACE PRIMER COMPOSITIONS AND METHODS OF USE SP1, GPER1, GRIN1 TRPA1 2167/4885CYP1A2 2409/4885CYP2A6 2166/4885

“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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