SCHEMBL7120560

SCHEMBL7120560

CC(=O)Nc1ncc(Oc2ccc(C(=O)N[C@@H]3C[C@H]4CC[C@@H]3N4)cc2)s1

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GCK P35557 9/20 0.42
RIPK2 O43353 2/20 0.38
ALDH1A1 P00352 2/20 0.35
NPC1 O15118 1/20 0.35
RAB9A P51151 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
CSNK2A2 P19784 2/20 0.35
CSNK2A1 P68400 2/20 0.35
LMNA P02545 1/20 0.34
HPGD P15428 1/20 0.34
MMP2 P08253 1/20 0.34
MMP7 P09237 1/20 0.34
MMP9 P14780 1/20 0.34
MMP13 P45452 1/20 0.34
OGA O60502 1/20 0.33

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
SCHEMBL7116208 0.88 POLB (0.36) GCKSMN1; SMN2MMP2MMP7MMP9
SCHEMBL7120608 0.87 POLB (0.37) GCKSMN1; SMN2MMP2MMP7MMP9
SCHEMBL7126688 0.85 MMP2 (0.35) GCKMMP2MMP7MMP9MMP13
SCHEMBL7124979 0.85 F10 (0.38) GCKALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL7124376 0.84 GLS (0.37) ALDH1A1NPC1RAB9ASMN1; SMN2CSNK2A2
SCHEMBL7231298 0.84 KMT2A (0.38) ALDH1A1SMN1; SMN2LMNAHPGDMMP2
SCHEMBL7127666 0.84 MMP2 (0.35) ALDH1A1MMP2MMP7MMP9MMP13
SCHEMBL7120336 0.83 ACACB (0.38) CSNK2A2CSNK2A1MMP2MMP7MMP9
SCHEMBL7116341 0.83 EPHX2 (0.35) GCKNPC1RAB9AMMP2MMP7
SCHEMBL7123807 0.82 SCN9A (0.37) GCKNPC1RAB9ASMN1; SMN2LMNA

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-20030069296-A1 Substituted-aryl 7-aza[2.2.1]bicycloheptanes for the treatment of disease PHARMACIA & UPJOHN COMPANY 2003-04-10 US claimed
US-20030069296-A1 Substituted-aryl 7-aza[2.2.1]bicycloheptanes for the treatment of disease PHARMACIA & UPJOHN COMPANY 2003-04-10 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-20030069296-A1 Substituted-aryl 7-aza[2.2.1]bicycloheptanes for the treatment of disease CYP7B1, UGT2B7, CYP1B1 GCK 1495/4885RIPK2 4371/4885ALDH1A1 870/4885

“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.