SCHEMBL3753867

SCHEMBL3753867

CC(C)(NC(=O)c1ccc(S(=O)(=O)Nc2ccccc2Oc2ccccc2)cc1)C(=O)N1CCC(CCN2CCCC2)CC1

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CCR2 P41597 7/20 0.42
KMT2A Q03164 3/20 0.42
CACNA1H O95180 1/20 0.42
CACNA1B Q00975 1/20 0.42
LIMK2 P53671 2/20 0.42
CNR1 P21554 1/20 0.41
CNR2 P34972 1/20 0.41
TGFBR1 P36897 1/20 0.41
MEN1 O00255 2/20 0.40
TDP1 Q9NUW8 1/20 0.40
LMNA P02545 1/20 0.40
GAA P10253 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
CHRM4 P08173 1/20 0.40

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
SCHEMBL2924675 0.86 CCR2 (0.42) CCR2KMT2ACACNA1HCACNA1BLIMK2
SCHEMBL2924677 0.86 CCR2 (0.42) CCR2KMT2ACACNA1HCACNA1BLIMK2
SCHEMBL3754021 0.86 CCR2 (0.42) CCR2KMT2ACACNA1HCACNA1BLIMK2
SCHEMBL3277546 0.86 CCR2 (0.47) CCR2KMT2ACACNA1HCACNA1BCNR1
SCHEMBL2905205 0.84 CCR2 (0.42) CCR2KMT2ACACNA1HCACNA1BLIMK2
SCHEMBL2905209 0.84 CCR2 (0.42) CCR2KMT2ACACNA1HCACNA1BLIMK2
SCHEMBL3751375 0.84 CCR2 (0.42) CCR2KMT2ACACNA1HCACNA1BLIMK2
SCHEMBL3149091 0.84 DRD2 (0.48) CCR2
SCHEMBL3149096 0.84 DRD2 (0.48) CCR2
SCHEMBL2897997 0.81 CHRM4 (0.44) CCR2KMT2AMEN1TDP1CHRM4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100298299-A1 NON-PEPTIDE DERIVATIVES AS BRADYKININ B1 ANTAGONISTS RICHTER GEDEON NYRT. (HU) 2010-11-25 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 (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-20100298299-A1 NON-PEPTIDE DERIVATIVES AS BRADYKININ B1 ANTAGONISTS BDKRB1, BDKRB2, NPBWR1 CCR2 611/4885KMT2A 4569/4885CACNA1H 1671/4885

“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.