SCHEMBL5237634

SCHEMBL5237634

Cc1cccc(-n2cc(C(=O)O)c(N(C(=O)C3CCC(C)CC3)C(C)C)n2)c1

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.41
NPC1 O15118 1/20 0.41
POLB P06746 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
ADORA3 P0DMS8 4/20 0.39
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
NOTUM Q6P988 2/20 0.36
LMNA P02545 2/20 0.36
KDM4E B2RXH2 1/20 0.36
MAPT P10636 1/20 0.36
ADORA1 P30542 3/20 0.35
ADORA2A P29274 1/20 0.35
GRM5 P41594 1/20 0.35
TYMS P04818 1/20 0.34
RPA1 P27694 1/20 0.33
HPGD P15428 1/20 0.33
SLC6A9 P48067 1/20 0.33

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
SCHEMBL5232564 1.00 ALDH1A1 (0.41) ALDH1A1NPC1POLBSMN1; SMN2ADORA3
SCHEMBL5231408 0.90 LMNA (0.37) POLBMEN1KMT2ANOTUMLMNA
SCHEMBL5237695 0.90 MLLT3 (0.34) ALDH1A1NPC1POLBSMN1; SMN2LMNA
SCHEMBL5238921 0.90 LMNA (0.37) POLBMEN1KMT2ANOTUMLMNA
SCHEMBL5228821 0.90 MLLT3 (0.34) ALDH1A1NPC1POLBSMN1; SMN2LMNA
SCHEMBL5233211 0.90 ALDH1A1 (0.32) ALDH1A1
SCHEMBL5229081 0.90 ALDH1A1 (0.32) ALDH1A1
SCHEMBL5230228 0.90 ALDH1A1 (0.39) ALDH1A1POLBSMN1; SMN2ADORA3MEN1
SCHEMBL5230218 0.90 ALDH1A1 (0.39) ALDH1A1POLBSMN1; SMN2ADORA3MEN1
SCHEMBL5228900 0.90 NOTUM (0.36) NPC1POLBSMN1; SMN2ADORA3MEN1

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
EP-1730116-B1 4-CARBOX PYRAZOLE DERIVATES USEFUL AS ANTI-VIRAL AGENTS SMITHKLINE BEECHAM CORP (US) 2007-09-05 EP claimed
US-20070167507-A1 4-Carbox pyrazole derivatives useful as anti-viral agents GLAXO GROUP LIMITED (GB) 2007-07-19 US claimed
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

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 ALDH1A1 1138/4885NPC1 352/4885POLB 1462/4885

“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.