SCHEMBL8512478

SCHEMBL8512478

CC(=O)c1c(Cl)cc(Cl)c(C(C)=O)c1S

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.39
CYP3A4 P08684 3/20 0.39
MEN1 O00255 2/20 0.39
HPGD P15428 2/20 0.39
THRB P10828 1/20 0.34
SMN1; SMN2 Q16637 2/20 0.32
LMNA P02545 1/20 0.32
HTT P42858 1/20 0.32
CAPN1 P07384 1/20 0.31
CTSL P07711 1/20 0.31
CTSB P07858 1/20 0.31
CA5A P35218 1/20 0.31
USP2 O75604 1/20 0.31
MAPK1 P28482 1/20 0.31
FSCN1 Q16658 1/20 0.31
ALDH1A1 P00352 2/20 0.30
MAPT P10636 1/20 0.30
PKM P14618 1/20 0.30

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
SCHEMBL8513199 0.76 CA12 (0.42) CYP3A4HPGDSMN1; SMN2LMNAHTT
SCHEMBL8509652 0.75 MEN1 (0.32) KMT2ACYP3A4MEN1HPGDTHRB
SCHEMBL2093961 0.75 KMT2A (0.44) KMT2ACYP3A4MEN1HPGDTHRB
SCHEMBL6512921 0.73 CYP3A4 (0.38) KMT2ACYP3A4MEN1HPGDTHRB
SCHEMBL14339400 0.73 KMT2A (0.42) KMT2ACYP3A4MEN1HPGDTHRB
SCHEMBL7263483 0.73 SMN1; SMN2 (0.44) KMT2ACYP3A4MEN1HPGDTHRB
SCHEMBL14400195 0.73 HPGD (0.46) KMT2ACYP3A4MEN1HPGDTHRB
SCHEMBL23518451 0.71 NMT1 (0.40) KMT2ACYP3A4MEN1HPGDTHRB
SCHEMBL7267961 0.71 SMN1; SMN2 (0.43) KMT2ACYP3A4MEN1HPGDTHRB
SCHEMBL8279321 0.71 THRB (0.48) KMT2ACYP3A4MEN1HPGDTHRB

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
US-8877869-B2 Method for selecting organic sulfur compound for golf ball, method for producing golf ball, and golf ball SRI SPORTS LIMITED (JP) 2014-11-04 US disclosed
US-20120135823-A1 METHOD FOR SELECTING ORGANIC SULFUR COMPOUND FOR GOLF BALL, METHOD FOR PRODUCING GOLF BALL, AND GOLF BALL SUMITOMO RUBBER INDUSTRIES, LTD. (JP) 2012-05-31 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-20120135823-A1 METHOD FOR SELECTING ORGANIC SULFUR COMPOUND FOR GOLF BALL, METHOD FOR PRODUCING GOLF BALL, AND GOLF BALL GIGYF2, FKBP4, GSS KMT2A 4145/4885CYP3A4 1394/4885MEN1 3444/4885

“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.