SCHEMBL4124688

SCHEMBL4124688

CCc1ccc(-c2ccsc2Cl)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP17A1 P05093 1/20 0.46
CYP2A6 P11509 1/20 0.43
POLB P06746 2/20 0.40
NPC1 O15118 1/20 0.40
GAA P10253 1/20 0.40
RAB9A P51151 1/20 0.40
EDNRB P24530 1/20 0.38
EDNRA P25101 1/20 0.38
PTGS1 P23219 1/20 0.38
FFAR4 Q5NUL3 1/20 0.36
EGFR P00533 1/20 0.35
S1PR1 P21453 1/20 0.35
S1PR5 Q9H228 1/20 0.35
TSHR P16473 1/20 0.34
MAPK1 P28482 1/20 0.34
ATM Q13315 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34

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
SCHEMBL547061 0.77 CYP2A6 (0.50) CYP17A1CYP2A6POLBRAB9AL3MBTL1
SCHEMBL547502 0.74 CYP2A6 (0.47) CYP17A1CYP2A6NPC1GAARAB9A
SCHEMBL1622032 0.73 PGR (0.41) POLBNPC1GAARAB9APTGS1
SCHEMBL13766280 0.73 EDNRB (0.38) POLBNPC1GAARAB9AEDNRB
SCHEMBL1942722 0.73 RORB (0.45) POLBNPC1GAARAB9AEDNRB
SCHEMBL8649337 0.73 CYP2A6 (0.60) CYP17A1CYP2A6MAPK1ALDH1A1HPGD
SCHEMBL1521833 0.69 CYP2A6 (0.47) CYP17A1CYP2A6
SCHEMBL27911621 0.69 PRKCZ (0.40) CYP17A1NPC1RAB9AFFAR4TDP1
Formic Acid SCHEMBL10703550 0.69 CYP2A6 (0.44) CYP17A1CYP2A6EDNRBEDNRAPTGS1
SCHEMBL28311793 0.69 CYP2A6 (0.55) CYP17A1CYP2A6MAPK1ALDH1A1HPGD

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-20090159876-A1 ORGANIC SEMICONDUCTOR MATERIAL AND ORGANIC FIELD EFFECT TRANSISTOR MITSUBISHI CHEMICAL CORPORATION (JP) 2009-06-25 US disclosed
EP-1947706-A1 ORGANIC SEMICONDUCTOR MATERIAL AND ORGANIC FIELD EFFECT TRANSISTOR Mitsubishi Chemical Corporation (JP) 2008-07-23 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-20090159876-A1 ORGANIC SEMICONDUCTOR MATERIAL AND ORGANIC FIELD EFFECT TRANSISTOR H1-4, OR10J3, EPCAM CYP17A1 3652/4885CYP2A6 2391/4885POLB 3305/4885

“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.