SCHEMBL6156026

SCHEMBL6156026

NCc1cccc(NN(C(=O)Nc2ccc(N3CCCCC3=O)c(C(F)(F)F)c2)c2ccccc2Cl)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPV1 Q8NER1 2/20 0.37
LMNA P02545 3/20 0.36
HPGD P15428 1/20 0.36
TSHR P16473 1/20 0.36
UBE2M P61081 3/20 0.35
DCUN1D1 Q96GG9 3/20 0.35
F10 P00742 2/20 0.35
HTT P42858 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
NPSR1 Q6W5P4 2/20 0.34
KDR P35968 1/20 0.34
HDAC6 Q9UBN7 1/20 0.34
TP53 P04637 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
KDM4E B2RXH2 1/20 0.34
MEN1 O00255 1/20 0.34
NPC1 O15118 1/20 0.34
GAA P10253 1/20 0.34
MAPT P10636 1/20 0.34
RAB9A P51151 1/20 0.34

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
SCHEMBL6156928 0.89 TPSAB1 (0.36) UBE2MDCUN1D1F10
SCHEMBL6156645 0.88 F10 (0.48) TRPV1F10
SCHEMBL6156424 0.83 LMNA (0.37) TRPV1LMNAHPGDTSHRF10
SCHEMBL5166370 0.79 F10 (0.54) F10
Hydrochloric Acid SCHEMBL27601426 0.79 F10 (0.53) F10
SCHEMBL6157569 0.77 TP53 (0.38) LMNAHPGDTSHRF10SMN1; SMN2
SCHEMBL6156474 0.77 F10 (0.47) UBE2MDCUN1D1F10
SCHEMBL6156018 0.76 S1PR1 (0.37) TRPV1LMNAHPGDTSHRSMN1; SMN2
SCHEMBL6159517 0.75 F10 (0.37) LMNAHPGDTSHRF10SMN1; SMN2
SCHEMBL6156664 0.75 TP53 (0.40) LMNAHPGDTSHRF10SMN1; SMN2

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 6 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
EP-1501814-A1 SEMICARBAZIDE DERIVATIVES FOR COMBATING THROMBOEMBOLIC DISEASES MERCK PATENT GmbH (DE) 2005-02-02 EP claimed
WO-2003093254-A1 SEMICARBAZIDE DERIVATIVES FOR COMBATING THROMBOEMBOLIC DISEASES MERCK PATENT GMBH (DE) 2003-11-13 WO 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 TRPV1 3373/4885LMNA 1705/4885HPGD 2249/4885

“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.