SCHEMBL4490618

SCHEMBL4490618

Cc1c(CNS(=O)(=O)c2cccc(Cl)c2)cc(-c2ccc(Cl)cc2Cl)n1-c1ccc(Cl)cc1

nearest known ligand 0.57

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
OPRL1 P41146 2/20 0.57
CHRNA7 P36544 1/20 0.47
ALDH1A1 P00352 2/20 0.41
NPC1 O15118 1/20 0.41
MAPT P10636 1/20 0.41
PKM P14618 1/20 0.40
HTR6 P50406 1/20 0.40
PTGS2 P35354 2/20 0.40
HSD11B1 P28845 5/20 0.39
CYP19A1 P11511 1/20 0.39
FLT1 P17948 1/20 0.38
FLT4 P35916 1/20 0.38
KDR P35968 1/20 0.38
PGR P06401 1/20 0.38
MEN1 O00255 1/20 0.38
KMT2A Q03164 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
SCHEMBL4476893 0.91 OPRL1 (0.52) OPRL1CHRNA7ALDH1A1MAPTPTGS2
SCHEMBL4490776 0.90 OPRL1 (0.51) OPRL1CHRNA7ALDH1A1NPC1MAPT
Hydrochloric Acid SCHEMBL4564842 0.73 OPRL1 (0.61) OPRL1CHRNA7KMT2A
SCHEMBL4492245 0.72 OPRL1 (0.46) OPRL1CHRNA7ALDH1A1MAPTPTGS2
SCHEMBL2903583 0.70 RXFP1 (0.47) ALDH1A1PKMHTR6HSD11B1CYP19A1
SCHEMBL4490567 0.69 OPRL1 (0.49) OPRL1ALDH1A1MAPTPTGS2KDR
SCHEMBL4490242 0.67 ALDH1A1 (0.42) ALDH1A1NPC1MAPTPKMHSD11B1
SCHEMBL4465707 0.66 NOTUM (0.63) OPRL1CHRNA7ALDH1A1
SCHEMBL14434546 0.66 ALDH1A1 (0.57) ALDH1A1NPC1MAPTCYP19A1FLT1
SCHEMBL3013581 0.66 CA12 (0.49) OPRL1CHRNA7PTGS2FLT1FLT4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7524971-B2 1,5-diarylpyrrole derivatives, preparation method thereof and application of same in therapeutics SANOFI - AVENTIS (FR) 2009-04-28 US disclosed
US-20080015245-A1 1,5-DIARYLPYRROLE DERIVATIVES, PREPARATION METHOD THEREOF AND APPLICATION OF SAME IN THERAPEUTICS SANOFI-AVENTIS (FR) 2008-01-17 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-20080015245-A1 1,5-DIARYLPYRROLE DERIVATIVES, PREPARATION METHOD THEREOF AND APPLICATION OF SAME IN THERAPEUTICS QDPR, DPYD, CD38 OPRL1 1286/4885CHRNA7 3779/4885ALDH1A1 100/4885

“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.