SCHEMBL7018387

SCHEMBL7018387

COC(=O)CCSCc1ccc(Cl)cc1

nearest known ligand 0.56

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 7/20 0.56
POLB P06746 2/20 0.56
TDP1 Q9NUW8 2/20 0.55
ABL1 P00519 1/20 0.55
RIN1 Q13671 1/20 0.55
HPGD P15428 3/20 0.55
USP2 O75604 1/20 0.53
MAPT P10636 5/20 0.53
SMN1; SMN2 Q16637 2/20 0.53
TP53 P04637 1/20 0.52
KMT2A Q03164 4/20 0.50
ALDH1A1 P00352 4/20 0.50
MEN1 O00255 2/20 0.50
CYP1A2 P05177 1/20 0.49
CYP3A4 P08684 1/20 0.49
CYP2D6 P10635 1/20 0.49
CYP2C9 P11712 1/20 0.49
CYP2C19 P33261 1/20 0.49

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
SCHEMBL7010071 0.86 ALDH1A1 (0.52) LMNAPOLBTDP1ABL1RIN1
SCHEMBL13870200 0.85 ALDH1A1 (0.60) LMNAPOLBTDP1ABL1RIN1
SCHEMBL11265645 0.85 ALDH1A1 (0.61) LMNAPOLBTDP1HPGDMAPT
SCHEMBL3702124 0.84 MEN1 (0.56) LMNAHPGDMAPTSMN1; SMN2TP53
SCHEMBL8895881 0.83 CYP2C19 (0.66) LMNAHPGDUSP2MAPTSMN1; SMN2
SCHEMBL13778166 0.81 SMN1; SMN2 (0.48) LMNATDP1ABL1RIN1HPGD
SCHEMBL10998413 0.81 SMN1; SMN2 (0.48) LMNATDP1ABL1RIN1MAPT
SCHEMBL9813424 0.80 CYP4F2 (0.51) LMNAPOLBTDP1HPGDUSP2
SCHEMBL197699 0.78 CYP11B1 (0.58) POLBKMT2AALDH1A1MEN1CYP1A2
SCHEMBL12204637 0.76 HPGD (0.60) LMNAPOLBHPGDUSP2MAPT

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-20030187023-A1 Sulfone derivatives, process for their production and use thereof TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2003-10-02 US disclosed
EP-1302462-A1 SULFONE DERIVATIVES, PROCESS FOR THEIR PRODUCTION AND USE THEREOF Takeda Chemical Industries, Ltd. (JP) 2003-04-16 EP 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-20030187023-A1 Sulfone derivatives, process for their production and use thereof SULT1E1, RRS1, SHH LMNA 3485/4885POLB 3954/4885TDP1 4829/4885

“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.