SCHEMBL2012299

SCHEMBL2012299

CCCCCCCCNC(=O)c1sccc1C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NAAA Q02083 4/20 0.54
ALDH1A1 P00352 4/20 0.52
HPGD P15428 3/20 0.52
GAA P10253 2/20 0.52
KDM4E B2RXH2 1/20 0.52
GLA P06280 1/20 0.52
MAPK1 P28482 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.49
LMNA P02545 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
HTT P42858 2/20 0.46
TSHR P16473 1/20 0.46
ALOX15 P16050 3/20 0.46
CYP1A2 P05177 1/20 0.46
CYP2C9 P11712 1/20 0.46
CYP2C19 P33261 1/20 0.46
THRA P10827 1/20 0.45
THRB P10828 1/20 0.45
MLYCD O95822 1/20 0.45
EPHX1 P07099 3/20 0.44

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
SCHEMBL20434453 1.00 NAAA (0.54) NAAAALDH1A1HPGDGAAKDM4E
SCHEMBL20434471 1.00 NAAA (0.54) NAAAALDH1A1HPGDGAAKDM4E
SCHEMBL13858907 0.94 HPGD (0.55) NAAAALDH1A1HPGDGAAKDM4E
SCHEMBL20436876 0.89 NAAA (0.54) NAAAALDH1A1HPGDGAAL3MBTL1
SCHEMBL13858935 0.82 TSHR (0.57) NAAAALDH1A1HPGDGAAKDM4E
SCHEMBL2186238 0.82 HPGD (0.61) ALDH1A1HPGDGAAKDM4EGLA
SCHEMBL20434469 0.78 HTT (0.60) ALDH1A1HPGDGAAKDM4EGLA
SCHEMBL7810359 0.77 ALOX15 (0.55) NAAAALDH1A1HPGDKDM4EMAPK1
SCHEMBL23610299 0.76 HTT (0.75) NAAAALDH1A1HPGDLMNASMN1; SMN2
SCHEMBL11089466 0.76 HTT (0.75) NAAAALDH1A1HPGDLMNASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180219160-A1 BENZOBIS(THIADIAZOLE) DERIVATIVE, INK COMPRISING THE SAME, AND ORGANIC ELECTRONIC DEVICE USING THE SAME UBE INDUSTRIES, LTD. (JP) 2018-08-02 US disclosed
US-20180219160-A1 BENZOBIS(THIADIAZOLE) DERIVATIVE, INK COMPRISING THE SAME, AND ORGANIC ELECTRONIC DEVICE USING THE SAME UBE INDUSTRIES, LTD. (JP) 2018-08-02 US disclosed
EP-2507287-A1 NOVEL PHOTOACTIVE POLYMERS Université Laval (CA) 2012-10-10 EP disclosed
WO-2011063534-A1 NOVEL PHOTOACTIVE POLYMERS UNIVERSITé LAVAL (CA) 2011-06-03 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-20180219160-A1 BENZOBIS(THIADIAZOLE) DERIVATIVE, INK COMPRISING THE SAME, AND ORGANIC ELECTRONIC DEVICE USING THE SAME IKZF3, HELZ, TEC NAAA 3544/4885ALDH1A1 246/4885HPGD 1765/4885

“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.