SCHEMBL1122756

SCHEMBL1122756

O=C(O)c1cccc(OCCSc2cccs2)c1

nearest known ligand 0.55

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.55
NR4A2 P43354 7/20 0.48
POLB P06746 1/20 0.47
PLA2G4B P0C869 1/20 0.45
NR1H4 Q96RI1 4/20 0.44
TBXAS1 P24557 1/20 0.44
AKR1C3 P42330 1/20 0.43
NPC1 O15118 1/20 0.43
RAB9A P51151 1/20 0.43
MEN1 O00255 1/20 0.42
ADRB2 P07550 1/20 0.42
MAPT P10636 1/20 0.42

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
SCHEMBL5720725 0.89 KMT2A (0.42) KMT2APOLBNPC1RAB9AMEN1
SCHEMBL1122939 0.86 KMT2A (0.45) KMT2APOLBNPC1RAB9AMEN1
SCHEMBL1123197 0.81 MEN1 (0.43) KMT2APOLBNR1H4NPC1RAB9A
SCHEMBL1122848 0.78 LMNA (0.46) KMT2APOLBNPC1RAB9AMEN1
SCHEMBL1122685 0.77 F10 (0.38) KMT2AMEN1
SCHEMBL9803295 0.77 KMT2A (0.80) KMT2ANR4A2POLBPLA2G4BNR1H4
SCHEMBL10787479 0.77 KMT2A (0.80) KMT2ANR4A2POLBPLA2G4BNR1H4
SCHEMBL30167982 0.77 KMT2A (0.80) KMT2ANR4A2POLBPLA2G4BNR1H4
SCHEMBL4509654 0.75 KMT2A (0.77) KMT2ANR4A2PLA2G4BNR1H4AKR1C3
SCHEMBL21119057 0.74 ACMSD (0.55) NPC1RAB9AMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1644321-B1 NEW BENZAMIDES AS PPATY MODULATORS S A L V A T LAB SA (ES) 2011-02-09 EP disclosed
US-20060160894-A1 Benzamides as ppar modulators LABORATORIOS S.A.L.V.A.T.,S.A. (ES) 2006-07-20 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-20060160894-A1 Benzamides as ppar modulators PPARD, PPARA, PPARG KMT2A 1515/4885NR4A2 66/4885POLB 791/4885

“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.