SCHEMBL5630404

SCHEMBL5630404

N=C1CCCCN1c1ccc(NC(=O)[C@H](NC(=O)Nc2ccc(Cl)cc2)c2ccccc2F)cc1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
F10 P00742 5/20 0.41
EP300 Q09472 2/20 0.39
CNR1 P21554 4/20 0.38
MAPT P10636 3/20 0.36
FPR1 P21462 2/20 0.36
FPR2 P25090 2/20 0.36
ALDH1A1 P00352 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
CNR2 P34972 1/20 0.36
NPC1 O15118 1/20 0.36
TP53 P04637 1/20 0.36
RAB9A P51151 1/20 0.36
MCL1 Q07820 1/20 0.36
ADRB2 P07550 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36

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
SCHEMBL5631458 0.97 F10 (0.42) F10EP300CNR1MAPTFPR1
SCHEMBL5632127 0.87 F10 (0.49) F10EP300CNR1MAPTFPR2
SCHEMBL5631599 0.87 F10 (0.49) F10EP300CNR1MAPTFPR2
SCHEMBL5631637 0.85 CYP1A2 (0.41) F10EP300MAPTALDH1A1SMN1; SMN2
SCHEMBL5631123 0.84 F10 (0.47) F10EP300CNR1MAPTFPR2
SCHEMBL5630997 0.84 F10 (0.47) F10EP300CNR1MAPTFPR2
SCHEMBL5631202 0.83 CYP1A2 (0.39) F10EP300MAPTALDH1A1SMN1; SMN2
SCHEMBL5631765 0.83 CYP1A2 (0.39) F10EP300MAPTALDH1A1SMN1; SMN2
SCHEMBL5631461 0.81 F10 (0.61) F10CNR1MAPTFPR2ALDH1A1
SCHEMBL8265403 0.80 F10 (0.42) F10EP300CNR1MAPTALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7183277-B2 Alpha-((aryl or heteroaryl)ureido or carbamoyloxy)-N-heteroaryl amides; blood-coagulation factor Xa and VIIa inhibitors; synergistic mixtures with other antitumor agents or anticoagulants MERCK PATENT GMBH (DE) 2007-02-27 US claimed
US-20050171154-A1 Carboxylic acid amides MERCK PATENT GMBH (DE) 2005-08-04 US claimed
US-7183277-B2 Alpha-((aryl or heteroaryl)ureido or carbamoyloxy)-N-heteroaryl amides; blood-coagulation factor Xa and VIIa inhibitors; synergistic mixtures with other antitumor agents or anticoagulants MERCK PATENT GMBH (DE) 2007-02-27 US disclosed
US-20050171154-A1 Carboxylic acid amides MERCK PATENT GMBH (DE) 2005-08-04 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-20050171154-A1 Carboxylic acid amides F11, F12, F2 F10 4/4885EP300 984/4885CNR1 151/4885

“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.