SCHEMBL5526019

SCHEMBL5526019

CCOC(=O)c1sc(C(C)(C)C)nc1Cc1cccc(-c2ccc(F)c(F)c2)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPM8 Q7Z2W7 7/20 0.45
MAPT P10636 6/20 0.43
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
CDC7 O00311 3/20 0.43
DBF4 Q9UBU7 3/20 0.43
KDM4E B2RXH2 4/20 0.41
HSP90AA1 P07900 1/20 0.41
CRHBP P24387 1/20 0.41
CRHR2 Q13324 1/20 0.41
DHODH Q02127 3/20 0.41
PTPN11 Q06124 1/20 0.40
ALDH1A1 P00352 3/20 0.40
HPGD P15428 2/20 0.40
HSD17B10 Q99714 2/20 0.40
ALOX15 P16050 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39

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
SCHEMBL5522743 0.88 TRPM8 (0.46) TRPM8MAPTMEN1KMT2ACDC7
SCHEMBL5522334 0.87 SMN1; SMN2 (0.39) MEN1KMT2AKDM4EALDH1A1NPC1
SCHEMBL5522721 0.86 TRPM8 (0.53) TRPM8MAPTMEN1KMT2ACDC7
SCHEMBL5520493 0.82 ALDH1A1 (0.46) TRPM8MAPTCDC7DBF4KDM4E
SCHEMBL5528919 0.81 TRPM8 (0.55) TRPM8MAPTMEN1KMT2ACDC7
SCHEMBL5524813 0.77 MAPT (0.41) TRPM8MAPTMEN1KMT2ACDC7
SCHEMBL1918783 0.75 ALDH1A1 (0.47) TRPM8MAPTMEN1KMT2ACDC7
SCHEMBL5527609 0.74 CACNA1G (0.38) KDM4EALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL5524844 0.74 CHRM4 (0.39) DHODHALDH1A1SMN1; SMN2
SCHEMBL5520170 0.74 KMT2A (0.46) TRPM8KMT2AKDM4ENPC1RAB9A

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 1 patent. 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

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 3522/4885MAPT 2190/4885MEN1 4532/4885

“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.