SCHEMBL25017145

SCHEMBL25017145

NCc1ccc2cc(C(=O)N[C@H]3CC[C@H](O)CC3)n(Cc3cccc4ccccc34)c2c1

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ F10 P00742 9/20 0.46
▸ CNR2 P34972 1/20 0.42
▸ SIGMAR1 Q99720 1/20 0.41
▸ DRD4 P21917 7/20 0.40
▸ F2 P00734 1/20 0.39
▸ KDM4E B2RXH2 1/20 0.39
▸ NPC1 O15118 1/20 0.39
▸ NR1I2 O75469 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ HPGD P15428 1/20 0.39
▸ AHR P35869 1/20 0.39
▸ HTT P42858 1/20 0.39
▸ RAB9A P51151 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39

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
SCHEMBL25016195 0.94 F10 (0.45) F10CNR2SIGMAR1DRD4F2
SCHEMBL25016287 0.94 F10 (0.45) F10CNR2SIGMAR1DRD4F2
SCHEMBL25016025 0.91 F10 (0.45) F10CNR2SIGMAR1DRD4F2
SCHEMBL25016818 0.90 F10 (0.50) F10CNR2SIGMAR1DRD4F2
SCHEMBL28598814 0.88 F10 (0.43) F10CNR2SIGMAR1DRD4F2
SCHEMBL25017450 0.88 F10 (0.43) F10CNR2SIGMAR1DRD4F2
SCHEMBL25016208 0.87 CNR2 (0.41) F10CNR2SIGMAR1KDM4ENPC1
SCHEMBL25017559 0.81 F10 (0.46) F10CNR2
SCHEMBL21822156 0.81 CCR2 (0.52) —
SCHEMBL31689671 0.81 CCR2 (0.52) —

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-20230043159-A1 MATRIPTASE 2 INHIBITORS AND USES THEREOF DISC MEDICINE, INC. 2023-02-09 — — 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-20230043159-A1 MATRIPTASE 2 INHIBITORS AND USES THEREOF MMP7, MATR3, SPINT2 F10 1548/4885CNR2 4734/4885SIGMAR1 4641/4885

“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.

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