SCHEMBL13858907

SCHEMBL13858907

CCCCNC(=O)c1sccc1C(=O)O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.55
ALDH1A1 P00352 2/20 0.55
GAA P10253 2/20 0.55
KDM4E B2RXH2 1/20 0.55
GLA P06280 1/20 0.55
MAPK1 P28482 1/20 0.55
HTT P42858 2/20 0.53
TSHR P16473 1/20 0.53
CYP2C9 P11712 2/20 0.51
CYP1A2 P05177 1/20 0.51
CYP2C19 P33261 1/20 0.51
SMN1; SMN2 Q16637 1/20 0.46
NAAA Q02083 2/20 0.45
ALOX15 P16050 3/20 0.44
ABCC1 P33527 1/20 0.43
BCL2 P10415 1/20 0.42
MCL1 Q07820 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
MAPT P10636 1/20 0.42
RAB9A P51151 1/20 0.42

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
SCHEMBL2012299 0.94 NAAA (0.54) HPGDALDH1A1GAAKDM4EGLA
SCHEMBL20434453 0.94 NAAA (0.54) HPGDALDH1A1GAAKDM4EGLA
SCHEMBL20434471 0.94 NAAA (0.54) HPGDALDH1A1GAAKDM4EGLA
SCHEMBL13858935 0.88 TSHR (0.57) HPGDALDH1A1GAAKDM4EGLA
SCHEMBL2186238 0.84 HPGD (0.61) HPGDALDH1A1GAAKDM4EGLA
SCHEMBL20436876 0.82 NAAA (0.54) HPGDALDH1A1GAAHTTTSHR
SCHEMBL20434469 0.80 HTT (0.60) HPGDALDH1A1GAAKDM4EGLA
SCHEMBL162452 0.78 HTT (0.60) HPGDALDH1A1GAAHTTTSHR
SCHEMBL4911370 0.75 KDM4E (0.67) HPGDALDH1A1GAAKDM4EGLA
SCHEMBL11820954 0.75 ALDH1A1 (0.62) HPGDALDH1A1GAAKDM4EGLA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9761810-B2 Organic semiconductor material E.T.C. S.R.L. (IT) 2017-09-12 US disclosed
US-9761810-B2 Organic semiconductor material E.T.C. S.R.L. (IT) 2017-09-12 US disclosed
US-9761810-B2 Organic semiconductor material E.T.C. S.R.L. (IT) 2017-09-12 US disclosed
CN-103547581-B Organic semiconductor material E.T.C.有限责任公司 2017-04-05 CN disclosed
US-20150311448-A1 ORGANIC SEMICONDUCTOR MATERIAL USINVEST LLC 2015-10-29 US disclosed
US-20150311448-A1 ORGANIC SEMICONDUCTOR MATERIAL USINVEST LLC 2015-10-29 US disclosed
US-20150311448-A1 ORGANIC SEMICONDUCTOR MATERIAL USINVEST LLC 2015-10-29 US disclosed
EP-2710012-B1 ORGANIC SEMICONDUCTOR MATERIAL E T C SRL (IT) 2015-06-24 EP disclosed
EP-2710012-B1 ORGANIC SEMICONDUCTOR MATERIAL E T C SRL (IT) 2015-06-24 EP disclosed
US-20140217374-A1 ORGANIC SEMICONDUCTOR MATERIAL E.T.C. S.R.L. (IT) 2014-08-07 US disclosed
US-20140217374-A1 ORGANIC SEMICONDUCTOR MATERIAL E.T.C. S.R.L. (IT) 2014-08-07 US disclosed
US-20140217374-A1 ORGANIC SEMICONDUCTOR MATERIAL E.T.C. S.R.L. (IT) 2014-08-07 US disclosed
EP-2710012-A1 ORGANIC SEMICONDUCTOR MATERIAL E.T.C. S.r.l. (IT) 2014-03-26 EP disclosed
WO-2012156948-A1 ORGANIC SEMICONDUCTOR MATERIAL E.T.C. S.R.L. (IT) 2012-11-22 WO disclosed
WO-2012156948-A1 ORGANIC SEMICONDUCTOR MATERIAL E.T.C. S.R.L. (IT) 2012-11-22 WO 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-20150311448-A1 ORGANIC SEMICONDUCTOR MATERIAL OR10J3, TST, OR51E2 HPGD 3947/4885ALDH1A1 2895/4885GAA 1996/4885

“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.