SCHEMBL4602264

SCHEMBL4602264

COc1cc(-c2ccc(C(=O)O)cc2C)cc(OC)c1OC

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TPMT P51580 2/20 0.51
CA12 O43570 1/20 0.51
CA1 P00915 1/20 0.51
CA2 P00918 1/20 0.51
CA4 P22748 1/20 0.51
CA6 P23280 1/20 0.51
CA7 P43166 1/20 0.51
CA9 Q16790 1/20 0.51
CA14 Q9ULX7 1/20 0.51
HTT P42858 2/20 0.49
RAB9A P51151 3/20 0.47
LMNA P02545 2/20 0.47
MAPK1 P28482 1/20 0.47
POLB P06746 2/20 0.47
CASP6 P55212 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
NEK2 P51955 1/20 0.47
LTB4R Q15722 1/20 0.46
NPC1 O15118 2/20 0.46
GAA P10253 2/20 0.46

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
SCHEMBL4640519 0.88 LMNA (0.52) TPMTCA12CA1CA2CA4
SCHEMBL5151167 0.85 CA12 (0.65) TPMTCA12CA1CA2CA4
SCHEMBL4640409 0.84 LMNA (0.59) TPMTCA12CA1CA2CA4
SCHEMBL4601701 0.82 TPMT (0.56) TPMTCA12CA1CA2CA4
SCHEMBL18386934 0.81 CA12 (0.51) TPMTCA12CA1CA2CA4
SCHEMBL4640449 0.81 RAB9A (0.58) TPMTCA12CA1CA2CA4
SCHEMBL3216968 0.81 TPMT (0.50) TPMTCA12CA1CA2CA4
SCHEMBL2037868 0.79 RXRA (0.64) TPMTCA12CA1CA2CA4
SCHEMBL1529031 0.78 CA12 (0.51) TPMTCA12CA1CA2CA4
SCHEMBL5156190 0.78 LMNA (0.68) TPMTCA12CA1CA2CA4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1912970-A2 ACYLTRYPTOPHANOLS FOR FERTILITY CONTROL Bayer Schering Pharma Aktiengesellschaft (DE) 2008-04-23 EP claimed
US-20070060573-A1 Acyltryptophanols BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2007-03-15 US claimed
WO-2007017289-A2 ACYLTRYPTOPHANOLS FOR FERTILITY CONTROL BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2007-02-15 WO claimed
US-20070060573-A1 Acyltryptophanols BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2007-03-15 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-20070060573-A1 Acyltryptophanols FSHR, NPY1R, NPY2R TPMT 3169/4885CA12 4549/4885CA1 4240/4885

“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.