SCHEMBL1919237

SCHEMBL1919237

COC(=O)c1sc(Br)nc1-c1ccc(-c2ccccc2)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPM8 Q7Z2W7 1/20 0.54
ALDH1A1 P00352 6/20 0.50
HPGD P15428 3/20 0.50
HSD17B10 Q99714 2/20 0.49
DHODH Q02127 2/20 0.48
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
CYP1A2 P05177 1/20 0.48
CYP2C9 P11712 1/20 0.48
CYP2C19 P33261 1/20 0.48
RORC P51449 1/20 0.47
SMN1; SMN2 Q16637 3/20 0.47
MAPT P10636 2/20 0.47
LMNA P02545 1/20 0.47
HTT P42858 1/20 0.47
NPSR1 Q6W5P4 1/20 0.47
KDM4E B2RXH2 2/20 0.46
CDC7 O00311 1/20 0.45
DBF4 Q9UBU7 1/20 0.45
NPC1 O15118 1/20 0.45

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
SCHEMBL7050439 0.87 ALDH1A1 (0.51) ALDH1A1HPGDDHODHMEN1KMT2A
SCHEMBL1918908 0.85 IKBKB (0.51) TRPM8ALDH1A1HPGDHSD17B10DHODH
SCHEMBL1919617 0.84 CDC7 (0.49) TRPM8ALDH1A1HPGDHSD17B10HTT
SCHEMBL9130552 0.83 DHODH (0.55) TRPM8ALDH1A1HPGDDHODHMEN1
SCHEMBL276196 0.82 NTRK1 (0.57) TRPM8ALDH1A1HPGDHSD17B10DHODH
SCHEMBL974923 0.82 TRPM8 (0.73) TRPM8ALDH1A1HPGDRORCSMN1; SMN2
SCHEMBL1919879 0.82 CDC7 (0.54) TRPM8ALDH1A1HPGDHSD17B10MEN1
SCHEMBL1919084 0.81 ALDH1A1 (0.74) TRPM8ALDH1A1HPGDHSD17B10DHODH
SCHEMBL2692137 0.81 F2RL3 (0.44) ALDH1A1MEN1KMT2AMAPTLMNA
SCHEMBL19669120 0.81 ALDH1A1 (0.72) TRPM8ALDH1A1HPGDHSD17B10DHODH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120108565-A1 PYRROLE CARBOXYLIC ACID DERIVATIVES AS ANTIBACTERIAL AGENTS RANBAXY LABORATORIES LIMITED (IN) 2012-05-03 US disclosed
EP-2326640-A1 PYRROLE CARBOXYLIC ACID DERIVATIVES AS ANTIBACTERIAL AGENTS Ranbaxy Laboratories Limited (IN) 2011-06-01 EP disclosed
WO-2010013222-A1 PYRROLE CARBOXYLIC ACID DERIVATIVES AS ANTIBACTERIAL AGENTS RANBAXY LABORATORIES LIMITED (IN) 2010-02-04 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-20120108565-A1 PYRROLE CARBOXYLIC ACID DERIVATIVES AS ANTIBACTERIAL AGENTS POLI, POLB, POLA1 TRPM8 3522/4885ALDH1A1 2042/4885HPGD 563/4885

“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.