SCHEMBL5237808

SCHEMBL5237808

CCOC(=O)c1cn(-c2ccc(C(=O)Nc3ccc(F)cc3)cc2)nc1N(C(=O)[C@H]1CC[C@H](C)CC1)C(C)C

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 8/20 0.41
KDM4E B2RXH2 2/20 0.41
HPGD P15428 1/20 0.41
RXFP1 Q9HBX9 1/20 0.41
TP53 P04637 2/20 0.40
NPSR1 Q6W5P4 1/20 0.40
RAB9A P51151 3/20 0.39
LMNA P02545 2/20 0.39
NPC1 O15118 2/20 0.39
KMT2A Q03164 2/20 0.39
UBE2N P61088 1/20 0.39
ADORA3 P0DMS8 1/20 0.39
ADORA2A P29274 1/20 0.39
ADORA1 P30542 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.38
MEN1 O00255 1/20 0.38
CASP3 P42574 1/20 0.38
TRPV1 Q8NER1 1/20 0.38
SENP7 Q9BQF6 1/20 0.38
GAA P10253 1/20 0.38

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
SCHEMBL5237816 1.00 MAPT (0.41) MAPTKDM4EHPGDRXFP1TP53
SCHEMBL5235118 1.00 MAPT (0.41) MAPTKDM4EHPGDRXFP1TP53
SCHEMBL5235105 1.00 MAPT (0.41) MAPTKDM4EHPGDRXFP1TP53
SCHEMBL5236453 0.93 MAPT (0.46) MAPTKDM4EHPGDTP53NPSR1
SCHEMBL5236446 0.93 MAPT (0.46) MAPTKDM4EHPGDTP53NPSR1
SCHEMBL5233765 0.92 MAPT (0.46) MAPTKDM4EHPGDTP53NPSR1
SCHEMBL5652560 0.92 MAPT (0.46) MAPTKDM4EHPGDTP53NPSR1
SCHEMBL5235387 0.91 NPC1 (0.46) KDM4EHPGDTP53NPSR1RAB9A
SCHEMBL5235380 0.91 NPC1 (0.46) KDM4EHPGDTP53NPSR1RAB9A
SCHEMBL5232510 0.89 KMT2A (0.44) MAPTKDM4ETP53RAB9ALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1730116-B1 4-CARBOX PYRAZOLE DERIVATES USEFUL AS ANTI-VIRAL AGENTS SMITHKLINE BEECHAM CORP (US) 2007-09-05 EP disclosed
EP-1730116-B1 4-CARBOX PYRAZOLE DERIVATES USEFUL AS ANTI-VIRAL AGENTS SMITHKLINE BEECHAM CORP (US) 2007-09-05 EP disclosed
US-20070167507-A1 4-Carbox pyrazole derivatives useful as anti-viral agents GLAXO GROUP LIMITED (GB) 2007-07-19 US disclosed
US-20070167507-A1 4-Carbox pyrazole derivatives useful as anti-viral agents GLAXO GROUP LIMITED (GB) 2007-07-19 US disclosed
US-20070167507-A1 4-Carbox pyrazole derivatives useful as anti-viral agents GLAXO GROUP LIMITED (GB) 2007-07-19 US disclosed
EP-1730116-A1 4-CARBOX PYRAZOLE DERIVATES USEFUL AS ANTI-VIRAL AGENTS SMITHKLINE BEECHAM CORPORATION (US) 2006-12-13 EP disclosed
WO-2005092863-A1 4-CARBOX PYRAZOLE DERIVATES USEFUL AS ANTI-VIRAL AGENTS SMITHKLINE BEECHAM CORPORATION (US) 2005-10-06 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-20070167507-A1 4-Carbox pyrazole derivatives useful as anti-viral agents HAVCR2, RPL35, ZC3HAV1L MAPT 4522/4885KDM4E 2215/4885HPGD 2212/4885

“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.