SCHEMBL7121804

SCHEMBL7121804

CC(=O)c1cc(Oc2ccc(C(=O)N[C@@H]3C[C@H]4CC[C@@H]3N4)cc2)ccn1

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDR P35968 8/20 0.40
BRAF P15056 5/20 0.39
RAF1 P04049 3/20 0.38
EPHX2 P34913 2/20 0.38
MAPK14 Q16539 1/20 0.38
MMP2 P08253 1/20 0.38
MMP7 P09237 1/20 0.38
MMP9 P14780 1/20 0.38
MMP13 P45452 1/20 0.38
EZH2 Q15910 1/20 0.36
RIPK1 Q13546 2/20 0.35
CSF1R P07333 4/20 0.35
PDGFRB P09619 1/20 0.35
KIT P10721 1/20 0.35
PDGFRA P16234 1/20 0.35
FLT3 P36888 1/20 0.35

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
SCHEMBL7123889 0.88 EZH2 (0.39) MMP2MMP7MMP9MMP13EZH2
SCHEMBL7123911 0.87 MAPK14 (0.43) KDRBRAFRAF1MAPK14CSF1R
SCHEMBL7116456 0.86 EGLN1 (0.39) MMP2MMP7MMP9MMP13EZH2
SCHEMBL7125176 0.86 HRH3 (0.42) MMP2MMP7MMP9MMP13EZH2
SCHEMBL7117240 0.86 TAS1R3 (0.43) KDRMMP2MMP7MMP9MMP13
SCHEMBL7116944 0.85 HPGD (0.46) MMP2MMP7MMP9MMP13EZH2
SCHEMBL7116799 0.84 KDR (0.39) KDREPHX2MMP2MMP7MMP9
SCHEMBL7125270 0.84 LOXL2 (0.38) MMP2MMP7MMP9MMP13
SCHEMBL7116320 0.83 SCN9A (0.39) KDRBRAFRAF1MMP2MMP7
SCHEMBL7117129 0.83 CHRNA7 (0.37) EZH2RIPK1

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 KDR 2299/4885BRAF 3842/4885RAF1 3685/4885

“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.