SCHEMBL4602200

SCHEMBL4602200

CCCOc1ccc(-c2cccc(OCC)c2)cc1C(=O)O

nearest known ligand 0.62

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PTPN11 Q06124 5/20 0.62
RXRA P19793 1/20 0.61
RXRB P28702 1/20 0.61
PTPN1 P18031 1/20 0.52
PTPN6 P29350 1/20 0.52
KMT2A Q03164 1/20 0.51
DHODH Q02127 4/20 0.49
LMNA P02545 1/20 0.48
MAPT P10636 1/20 0.48
FFAR1 O14842 2/20 0.47
PPARD Q03181 1/20 0.47
SLC13A5 Q86YT5 1/20 0.47
NOTUM Q6P988 1/20 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
SCHEMBL4600995 0.95 PTPN11 (0.65) PTPN11RXRARXRBPTPN1PTPN6
SCHEMBL4603210 0.90 PTPN11 (0.62) PTPN11RXRARXRBPTPN1PTPN6
SCHEMBL4603021 0.89 PTPN11 (0.65) PTPN11RXRARXRBPTPN1PTPN6
SCHEMBL4599953 0.87 PTPN11 (0.57) PTPN11RXRARXRBPTPN1PTPN6
SCHEMBL4601726 0.87 PTPN11 (0.68) PTPN11RXRARXRBPTPN1PTPN6
SCHEMBL4601658 0.86 PTPN11 (0.67) PTPN11PTPN1PTPN6KMT2A
SCHEMBL4601924 0.86 PTPN11 (0.56) PTPN11RXRARXRBPTPN1PTPN6
SCHEMBL4601762 0.84 PTPN11 (0.65) PTPN11PTPN1PTPN6KMT2ADHODH
SCHEMBL4600952 0.84 PTPN11 (0.85) PTPN11PTPN1PTPN6KMT2ALMNA
SCHEMBL4602661 0.84 PTPN11 (0.65) PTPN11PTPN1PTPN6KMT2ADHODH

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 PTPN11 3529/4885RXRA 1256/4885RXRB 1669/4885

“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.