SCHEMBL6097407

SCHEMBL6097407

[CH2]CNS(=O)(=O)c1c(C)nn(C)c1Cl

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 1/20 0.45
HTR6 P50406 1/20 0.43
ACLY P53396 2/20 0.42
FPR2 P25090 4/20 0.40
PROKR1 Q8TCW9 4/20 0.40
NMT1 P30419 2/20 0.38
CCR2 P41597 1/20 0.38
SGK1 O00141 3/20 0.38
L3MBTL1 Q9Y468 3/20 0.38
TSHR P16473 1/20 0.37
BCL2 P10415 1/20 0.34
BCL2L1 Q07817 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
SCHEMBL16508903 0.84 HTR6 (0.46) MCL1HTR6ACLYFPR2PROKR1
SCHEMBL12067166 0.81 HTR6 (0.44) MCL1HTR6ACLYFPR2PROKR1
SCHEMBL15882311 0.78 ACLY (0.50) MCL1HTR6ACLYFPR2PROKR1
SCHEMBL1626536 0.75 L3MBTL1 (0.42) MCL1HTR6ACLYFPR2PROKR1
SCHEMBL3956139 0.75 ACLY (0.51) MCL1HTR6ACLYFPR2PROKR1
SCHEMBL6828482 0.75 ACLY (0.48) MCL1HTR6ACLYFPR2PROKR1
SCHEMBL12932804 0.75 MCL1 (0.49) MCL1HTR6ACLYFPR2PROKR1
SCHEMBL13677614 0.74 HTR6 (0.44) MCL1HTR6ACLYFPR2PROKR1
SCHEMBL1641772 0.73 L3MBTL1 (0.43) MCL1HTR6ACLYFPR2PROKR1
SCHEMBL388129 0.73 L3MBTL1 (0.43) MCL1HTR6ACLYFPR2PROKR1

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 MCL1 4311/4885HTR6 1373/4885ACLY 2345/4885

“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.