SCHEMBL6098538

SCHEMBL6098538

FC(F)(F)Oc1ccc(Oc2ccccc2-c2cc[c]cc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NCOA1 Q15788 1/20 0.47
NCOA3 Q9Y6Q9 1/20 0.47
SLC6A2 P23975 1/20 0.47
SLC6A4 P31645 1/20 0.47
SLC6A3 Q01959 1/20 0.47
AR P10275 1/20 0.45
FFAR4 Q5NUL3 3/20 0.41
PTGS2 P35354 1/20 0.39
SCN9A Q15858 3/20 0.38
GPR3 P46089 1/20 0.38
BRD4 O60885 2/20 0.38
HCRTR1 O43613 2/20 0.36
HCRTR2 O43614 2/20 0.36
CHRM5 P08912 1/20 0.36
FFAR1 O14842 1/20 0.35
TRPA1 O75762 1/20 0.35
SERPINE1 P05121 1/20 0.34
NISCH Q9Y2I1 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
SCHEMBL3992772 0.85 AR (0.48) NCOA1NCOA3SLC6A4ARFFAR4
SCHEMBL699801 0.84 FFAR4 (0.47) FFAR4SCN9ATRPA1
SCHEMBL3990509 0.82 NCOA1 (0.58) NCOA1NCOA3SLC6A2SLC6A4SLC6A3
SCHEMBL10469321 0.81 SLC6A2 (0.41) NCOA1NCOA3SLC6A2SLC6A4SLC6A3
SCHEMBL6099374 0.80 NCOA1 (0.51) NCOA1NCOA3SLC6A2SLC6A4SLC6A3
SCHEMBL4829554 0.79 NCOA1 (0.47) NCOA1NCOA3ARFFAR4PTGS2
SCHEMBL28263221 0.79 NCOA1 (0.62) NCOA1NCOA3ARFFAR4PTGS2
SCHEMBL5542762 0.77 SLC6A2 (0.43) SLC6A2SLC6A4SLC6A3ARFFAR4
SCHEMBL5547102 0.76 GPR3 (0.46) FFAR4GPR3CHRM5FFAR1
SCHEMBL920510 0.76 EPHX2 (0.42) SLC6A2SLC6A4SLC6A3SCN9AGPR3

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
US-7122580-B2 Aryl and heteroaryl compounds and methods to modulate coagulation TRANSTECH PHARMA, INC. (US) 2006-10-17 US claimed
EP-1546089-A2 ARYL AND HETEROARYL COMPOUNDS AND METHODS TO MODULATE COAGULATION TransTech Pharma Inc. (US) 2005-06-29 EP claimed
US-20040110832-A1 management, treatment and/or control of diseases caused in intrinsic clotting pathway utilizing factor IX such as stroke, myocardial infarction, aneurysm surgery, and deep vein thrombosis associated with surgical procedures etc TRANSTECH PHARMA, LLC 2004-06-10 US claimed
WO-2004014844-A2 ARYL AND HETEROARYL COMPOUNDS AND METHODS TO MODULATE COAGULATION TRANSTECH PHARMA, INC. (US) 2004-02-19 WO claimed

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-20040110832-A1 management, treatment and/or control of diseases caused in intrinsic clotting pathway utilizing factor IX such as stroke, myocardial infarction, aneurysm surgery, and deep vein thrombosis associated with surgical procedures etc TFPI, F9, TFPI2 NCOA1 4297/4885NCOA3 3634/4885SLC6A2 4407/4885

“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.