SCHEMBL3983335

SCHEMBL3983335

Cc1ccc(S(=O)(=O)OCCC2(c3ccc(Cl)c(Cl)c3)CCCN(C(=O)Cc3cc(C(F)(F)F)cc(C(F)(F)F)c3)C2)cc1

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CCR5 P51681 1/20 0.41
TACR2 P21452 1/20 0.40
TACR1 P25103 1/20 0.40
CNR1 P21554 1/20 0.38
USP2 O75604 1/20 0.38
GLA P06280 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2D6 P10635 1/20 0.38
TSHR P16473 1/20 0.38

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
SCHEMBL3980158 0.94 EPHX2 (0.42) CCR5TACR2TACR1CNR1
SCHEMBL3979446 0.92 TACR1 (0.44) CCR5TACR2TACR1CYP3A4CYP2D6
SCHEMBL3981258 0.90 TACR2 (0.37) CCR5TACR2TACR1CNR1
SCHEMBL3981791 0.90 TACR2 (0.45) CCR5TACR2TACR1USP2CYP3A4
SCHEMBL9029048 0.90 TACR2 (0.42) CCR5TACR2TACR1USP2GLA
SCHEMBL9026960 0.90 TACR2 (0.42) CCR5TACR2TACR1USP2GLA
SCHEMBL9027646 0.87 TACR2 (0.42) CCR5TACR2TACR1
SCHEMBL9027505 0.87 TACR2 (0.42) CCR5TACR2TACR1
SCHEMBL9026988 0.87 CYP3A4 (0.41) TACR1CNR1USP2GLACYP3A4
SCHEMBL3981253 0.85 TACR1 (0.39) CCR5TACR2TACR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070135434-A1 Sulfonyloxy derivatives SANKYO COMPANY, LIMITED (JP) 2007-06-14 US claimed
EP-1754701-A1 SULFONYLOXY DERIVATIVES Sankyo Company, Limited (JP) 2007-02-21 EP claimed
US-7560549-B2 Sulfonyloxy derivatives SANKYO COMPANY, LIMITED (JP) 2009-07-14 US disclosed
US-20070135434-A1 Sulfonyloxy derivatives SANKYO COMPANY, LIMITED (JP) 2007-06-14 US disclosed
EP-1754701-A1 SULFONYLOXY DERIVATIVES Sankyo Company, Limited (JP) 2007-02-21 EP 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-20070135434-A1 Sulfonyloxy derivatives TACR1, NPSR1, TACR2 CCR5 1713/4885TACR2 3/4885TACR1 1/4885

“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.