SCHEMBL12421573

SCHEMBL12421573

COCc1ccc(C(C)(C)O)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ESR1 P03372 6/20 0.41
▸ ESR2 Q92731 5/20 0.41
▸ APP P05067 1/20 0.38
▸ NR4A2 P43354 1/20 0.38
▸ RXRA P19793 1/20 0.38
▸ RXRB P28702 1/20 0.38
▸ IDO1 P14902 2/20 0.36
▸ MEN1 O00255 2/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ CHRM4 P08173 1/20 0.36
▸ HRH3 Q9Y5N1 1/20 0.36
▸ CALM1 P0DP23 1/20 0.35
▸ PDK2 Q15119 1/20 0.35
▸ POLB P06746 1/20 0.35
▸ LMNA P02545 1/20 0.34
▸ TYR P14679 1/20 0.34
▸ CYP3A4 P08684 1/20 0.34
▸ AR P10275 1/20 0.34
▸ HPGD P15428 1/20 0.34
▸ TSHR P16473 1/20 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
SCHEMBL9344511 0.84 TSHR (0.42) ESR1ESR2APPNR4A2RXRA
SCHEMBL9343512 0.84 TSHR (0.42) ESR1ESR2APPNR4A2RXRA
SCHEMBL10601214 0.82 ESR1 (0.48) ESR1ESR2APPNR4A2RXRA
SCHEMBL780050 0.82 APP (0.53) APPNR4A2RXRARXRBMEN1
SCHEMBL9876082 0.81 PTPN2 (0.50) ESR1ESR2APPNR4A2RXRA
SCHEMBL11308991 0.79 APP (0.41) ESR1ESR2APPNR4A2RXRA
SCHEMBL24533723 0.79 APP (0.61) APPNR4A2RXRARXRBHRH3
SCHEMBL9347553 0.79 PTPN2 (0.49) ESR1ESR2APPNR4A2RXRA
SCHEMBL9342878 0.79 PTPN2 (0.49) ESR1ESR2APPNR4A2RXRA
SCHEMBL18911060 0.79 ESR1 (0.39) ESR1ESR2APPNR4A2RXRA

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
EP-2534281-B1 METHOD FOR PRODUCING 4-ISOPROPYLCYCLOHEXYLMETHANOL BASF SE (DE) 2019-01-09 — — EP disclosed
US-20110207968-A1 PROCESS FOR PREPARING 4-ISOPROPYLCYCLOHEXYLMETHANOL BASF SE (DE) 2011-08-25 — — 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-20110207968-A1 PROCESS FOR PREPARING 4-ISOPROPYLCYCLOHEXYLMETHANOL CYP2E1, CYP3A4, DHPS ESR1 2660/4885ESR2 3066/4885APP 1084/4885

“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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