SCHEMBL17722824

SCHEMBL17722824

CCC(C)(C)c1ccc2ccccc2c1O

nearest known ligand 0.68

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ CYP1A2 P05177 1/20 0.53
▸ CYP2D6 P10635 1/20 0.53
▸ CYP2C9 P11712 1/20 0.53
▸ HPGD P15428 1/20 0.53
▸ CYP2C19 P33261 1/20 0.53
▸ HIF1A Q16665 1/20 0.53
▸ HSD17B10 Q99714 1/20 0.53
▸ PTPN22 Q9Y2R2 1/20 0.47
▸ LDHA P00338 1/20 0.41

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
SCHEMBL20340743 0.86 CYP1A2 (0.53) CYP1A2CYP2D6CYP2C9HPGDCYP2C19
SCHEMBL19725597 0.83 CYP1A2 (0.47) CYP1A2CYP2D6CYP2C9HPGDCYP2C19
SCHEMBL2220947 0.81 HSD17B10 (0.59) CYP1A2CYP2D6CYP2C9HPGDCYP2C19
SCHEMBL22473836 0.81 HSD17B10 (0.59) CYP1A2CYP2D6CYP2C9HPGDCYP2C19
SCHEMBL10895591 0.81 CYP1A2 (0.51) CYP1A2CYP2D6CYP2C9HPGDCYP2C19
SCHEMBL11579285 0.80 HSD17B10 (0.39) CYP1A2CYP2D6CYP2C9HPGDCYP2C19
SCHEMBL17722807 0.79 KCNJ11 (0.40) CYP1A2CYP2D6CYP2C9HPGDCYP2C19
SCHEMBL19725590 0.79 HPGD (0.50) CYP1A2CYP2D6CYP2C9HPGDCYP2C19
SCHEMBL2127614 0.79 ALDH1A1 (0.43) CYP1A2CYP2D6CYP2C9HPGDCYP2C19
SCHEMBL27908454 0.79 HSD17B10 (0.38) CYP1A2CYP2D6CYP2C9HPGDCYP2C19

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-20160122269-A1 COMPOUND CONTAINING PHENOLIC HYDROXYL GROUP, PHENOLIC RESIN, CURABLE COMPOSITION, CURED PRODUCT THEREOF, SEMICONDUCTOR SEALING MATERIAL, AND PRINTED CIRCUIT BOARD DIC CORPORATION (JP) 2016-05-05 — — 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-20160122269-A1 COMPOUND CONTAINING PHENOLIC HYDROXYL GROUP, PHENOLIC RESIN, CURABLE COMPOSITION, CURED PRODUCT THEREOF, SEMICONDUCTOR SEALING MATERIAL, AND PRINTED CIRCUIT BOARD ASH2L, SEM1, KDM1A CYP1A2 924/4885CYP2D6 2938/4885CYP2C9 1276/4885

“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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