SCHEMBL1108985

SCHEMBL1108985

CCCCCCCCCCCCc1cc(I)sc1-c1nc(CCCCCCCCCCCC)c(Cl)s1

nearest known ligand 0.32

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GPR35 Q9HC97 1/20 0.32
MEN1 O00255 1/20 0.31
TP53 P04637 1/20 0.31
CYP3A4 P08684 1/20 0.31
ALOX5 P09917 1/20 0.31
MAPT P10636 1/20 0.31
TYR P14679 1/20 0.31
ALOX15 P16050 1/20 0.31
TSHR P16473 1/20 0.31
HTT P42858 1/20 0.31
KMT2A Q03164 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
PTGS2 P35354 2/20 0.30
KCNH2 Q12809 1/20 0.30
TLR8 Q9NR97 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
SCHEMBL17188250 0.86 GPR35 (0.32) GPR35MEN1TP53CYP3A4ALOX5
SCHEMBL4297344 0.81 GAA (0.36) GPR35MEN1TP53CYP3A4ALOX5
SCHEMBL1108974 0.81
SCHEMBL12730032 0.80 GPR35 (0.41) GPR35MEN1TP53CYP3A4ALOX5
SCHEMBL1108989 0.79 KCNH2 (0.33) GPR35MEN1TP53CYP3A4ALOX5
SCHEMBL2848987 0.77 GPR35 (0.39) GPR35MEN1TP53CYP3A4ALOX5
SCHEMBL13566350 0.74 ALDH1A1 (0.36) MEN1MAPTKMT2APTGS2KCNH2
SCHEMBL12921574 0.73 MEN1 (0.32) GPR35MEN1TP53CYP3A4ALOX5
SCHEMBL5948466 0.73 TYR (0.32) GPR35MEN1TP53CYP3A4ALOX5
SCHEMBL12921571 0.73 MEN1 (0.32) GPR35MEN1TP53CYP3A4ALOX5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8154016-B2 Composition containing thiazole rings, organic semiconductor polymer containing the composition, organic active layer containing the organic semiconductor polymer, organic thin film transistor containing the organic active layer, electronic device containing the organic thin film transistor and method of preparing the same SAMSUNG ELECTRONICS CO., LTD. (KR) 2012-04-10 US disclosed
US-8026369-B2 hetero arylene or arylene showing p-type semiconductor property, thiophene showing p-type semiconductor property and thiazole rings showing a n-type semiconductor property at a polymer main chain; increased solubility to an organic solvent, coplanarity, processibility and improved thin film property SAMSUNG ELECTRONICS CO., LTD. (KR) 2011-09-27 US disclosed
US-20110209762-A1 Composition containing thiazole rings, organic semiconductor polymer containing the composition, organic active layer containing the organic semiconductor polymer, organic thin film transistor containing the organic active layer, electronic device containing the organic thin film transistor and method of preparing the same LEE BANG LIN 2011-09-01 US disclosed
EP-1953155-B1 Composition containing thiazole rings, organic semiconductor polymer containing the composition, organic active layer containing the organic semiconductor polymer, organic thin film transistor containing the organic active layer, electronic device containing the organic thin film transistor and method of preparing the same SAMSUNG ELECTRONICS CO LTD (KR) 2011-03-02 EP disclosed
US-20080191201-A1 Composition containing thiazole rings, organic semiconductor polymer containing the composition, organic active layer containing the organic semiconductor polymer, organic thin film transistor containing the organic active layer, electronic device containing the organic thin film transistor and method of preparing the same SAMSUNG ELECTRONICS CO., LTD. (KR) 2008-08-14 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-20080191201-A1 Composition containing thiazole rings, organic semiconductor polymer containing the composition, organic active layer containing the organic semiconductor polymer, organic thin film transistor containing the organic active layer, electronic device containing the organic thin film transistor and method of preparing the same TPR, TST, POU2F1 GPR35 4400/4885MEN1 4087/4885TP53 2230/4885

“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.