SCHEMBL6156474

SCHEMBL6156474

NCc1cccc(NN(C(=O)Nc2ccc(N3CCOCC3=O)c(C(F)(F)F)c2)c2ccccc2)c1

nearest known ligand 0.47

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
F10 P00742 12/20 0.47
RAF1 P04049 3/20 0.37
BRAF P15056 3/20 0.37
UBE2M P61081 1/20 0.35
DCUN1D1 Q96GG9 1/20 0.35
CYP2C9 P11712 1/20 0.35
CASR P41180 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
SCHEMBL6156645 0.90 F10 (0.48) F10RAF1BRAF
SCHEMBL6156079 0.88 F10 (0.44) F10CASR
SCHEMBL6156928 0.88 TPSAB1 (0.36) F10UBE2MDCUN1D1
SCHEMBL6157122 0.84 F10 (0.47) F10RAF1BRAFCYP2C9
SCHEMBL6156081 0.83 F10 (0.43) F10RAF1BRAF
SCHEMBL6156132 0.79 F10 (0.47) F10RAF1BRAF
SCHEMBL6156954 0.78 SMN1; SMN2 (0.51) CYP2C9
SCHEMBL6156026 0.77 TRPV1 (0.37) F10UBE2MDCUN1D1
SCHEMBL6156664 0.76 TP53 (0.40) F10CYP2C9
SCHEMBL6156412 0.75 KDM1A (0.41) CASR

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-20050171102-A1 Semicarbazide derivatives for combating thromboembolic diseases MERCK PATENT GMBH (DE) 2005-08-04 US claimed
US-20050171102-A1 Semicarbazide derivatives for combating thromboembolic diseases MERCK PATENT GMBH (DE) 2005-08-04 US disclosed
EP-1501814-A1 SEMICARBAZIDE DERIVATIVES FOR COMBATING THROMBOEMBOLIC DISEASES MERCK PATENT GmbH (DE) 2005-02-02 EP disclosed
WO-2003093254-A1 SEMICARBAZIDE DERIVATIVES FOR COMBATING THROMBOEMBOLIC DISEASES MERCK PATENT GMBH (DE) 2003-11-13 WO 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-20050171102-A1 Semicarbazide derivatives for combating thromboembolic diseases SERPINC1, F11, F12 F10 6/4885RAF1 1083/4885BRAF 1778/4885

“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.