SCHEMBL6158567

SCHEMBL6158567

Fc1ccccc1Oc1ccc(CCl)cc1

nearest known ligand 0.52

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
DAO P14920 1/20 0.52
PARP10 Q53GL7 1/20 0.51
LPAR1 Q92633 16/20 0.49
LPAR5 Q9H1C0 16/20 0.49
TTR P02766 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
SCHEMBL8546181 0.86 TTR (0.58) DAOTTR
SCHEMBL6293051 0.84 PARP10 (0.66) DAOPARP10LPAR1LPAR5
SCHEMBL6157137 0.82 HSPB1 (0.54) TTR
SCHEMBL6289863 0.82 PARP10 (0.63) DAOPARP10LPAR1LPAR5
SCHEMBL2091496 0.81 PARP10 (0.51) DAOPARP10LPAR1LPAR5
SCHEMBL28770201 0.81 PARP10 (0.56) DAOPARP10LPAR1LPAR5
SCHEMBL3520758 0.81 PARP10 (0.51) DAOPARP10LPAR1LPAR5
SCHEMBL2954809 0.81 LTA4H (0.60) DAOPARP10LPAR1LPAR5TTR
SCHEMBL507282 0.81 MAOB (0.56) DAOPARP10LPAR1LPAR5
SCHEMBL10689395 0.81 PARP10 (0.51) DAOPARP10LPAR1LPAR5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6953789-B2 Thiol compounds, their production and use TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2005-10-11 US disclosed
US-20040157894-A1 Thiol compounds, their production and use TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2004-08-12 US disclosed
US-6699881-B2 MATRIX METALLOPROTEASE INHIBITORS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2004-03-02 US disclosed
US-20030078253-A1 Thiol compounds, their production and use TAKEDA PHARMACEUTICAL COMPANY, LIMITED (JP) 2003-04-24 US disclosed
US-6420415-B1 Thiol compounds, their production and use TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 2002-07-16 US disclosed
EP-1132379-A1 NOVEL THIOL DERIVATIVES, PROCESS FOR PRODUCING THE SAME AND UTILIZATION THEREOF Takeda Chemical Industries, Ltd. (JP) 2001-09-12 EP disclosed
US-4331821-A ULTRAVIOLET RADIATION OF A VAPORIZED ALKYLBENZEN AND HALOGEN GAS MIXTURE BAYER AKTIENGESELLSCHAFT (DE) 1982-05-25 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 (2 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-20030078253-A1 Thiol compounds, their production and use TST, QSOX1, SULT1E1 DAO 173/4885PARP10 2828/4885LPAR1 3624/4885
US-20040157894-A1 Thiol compounds, their production and use TST, SULT1E1, QSOX1 DAO 207/4885PARP10 2624/4885LPAR1 3731/4885

“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.