SCHEMBL4125136

SCHEMBL4125136

O=C(O)CC1SC(c2cccc(Cl)c2Cl)c2cc(Cl)ccc2NC1=O.O=C(O)C[C@@H]1S[C@@H](c2cccc(Cl)c2Cl)c2cc(Cl)ccc2NC1=O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.45
CYP2C9 P11712 2/20 0.45
TSHR P16473 2/20 0.45
CYP2C19 P33261 2/20 0.45
TP53 P04637 1/20 0.45
CYP1A2 P05177 1/20 0.45
ALOX15 P16050 1/20 0.45
CASP1 P29466 1/20 0.45
RECQL P46063 1/20 0.45
SLC8B1 Q6J4K2 1/20 0.45
GLA P06280 1/20 0.42
HSD17B10 Q99714 1/20 0.42
CDYL2 Q8N8U2 1/20 0.41
CDYL Q9Y232 1/20 0.41
HTT P42858 4/20 0.37
KMT2A Q03164 5/20 0.36
MEN1 O00255 4/20 0.36
LMNA P02545 3/20 0.36
CACNB4 O00305 1/20 0.36
CACNA1A O00555 1/20 0.36

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
SCHEMBL4121445 1.00 MAPT (0.45) MAPTCYP2C9TSHRCYP2C19TP53
SCHEMBL4121440 1.00 MAPT (0.45) MAPTCYP2C9TSHRCYP2C19TP53
SCHEMBL4121444 1.00 MAPT (0.45) MAPTCYP2C9TSHRCYP2C19TP53
SCHEMBL14146204 0.91 GLA (0.42) MAPTCYP2C9TSHRCYP2C19TP53
SCHEMBL4110833 0.91 MAPT (0.55) MAPTCYP2C9TSHRCYP2C19TP53
SCHEMBL4110842 0.91 MAPT (0.55) MAPTCYP2C9TSHRCYP2C19TP53
SCHEMBL4110835 0.91 MAPT (0.55) MAPTCYP2C9TSHRCYP2C19TP53
SCHEMBL4123154 0.88 EGFR (0.43) MAPTCYP2C9TSHRCYP2C19TP53
SCHEMBL4123148 0.88 EGFR (0.43) MAPTCYP2C9TSHRCYP2C19TP53
SCHEMBL4123158 0.88 EGFR (0.43) MAPTCYP2C9TSHRCYP2C19TP53

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-20090181942-A1 TRICYCLIC COMPOUNDS DAIICHI SANKYO COMPANY, LIMITED (JP) 2009-07-16 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-20090181942-A1 TRICYCLIC COMPOUNDS FDFT1, COASY, HMGCR MAPT 4428/4885CYP2C9 1280/4885TSHR 1672/4885

“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.