SCHEMBL16708762

SCHEMBL16708762

CCN(C=O)Cc1ccncc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
USP2 O75604 2/20 0.42
POLB P06746 1/20 0.41
ALDH1A1 P00352 4/20 0.40
HSD17B10 Q99714 3/20 0.40
PKM P14618 1/20 0.40
HTT P42858 1/20 0.40
RECQL P46063 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
CYP2C9 P11712 4/20 0.39
CYP2C19 P33261 4/20 0.39
LMNA P02545 3/20 0.39
CYP1A2 P05177 3/20 0.39
CYP3A4 P08684 3/20 0.39
TSHR P16473 2/20 0.39
MAPT P10636 2/20 0.39
KMT2A Q03164 2/20 0.39
MEN1 O00255 1/20 0.39
CHRM2 P08172 1/20 0.39
CHRM4 P08173 1/20 0.39

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
SCHEMBL13335317 0.81 MAPK1 (0.39) USP2POLBALDH1A1HSD17B10PKM
SCHEMBL968495 0.80 LMNA (0.48) ALDH1A1LMNATSHRMAPK1KDM4E
SCHEMBL5513954 0.76 MMP13 (0.39) USP2ALDH1A1HSD17B10PKMHTT
SCHEMBL9499782 0.73 HRH3 (0.33) ALDH1A1HTTSMN1; SMN2CYP2C9CYP2C19
SCHEMBL6637369 0.73 HRH3 (0.60) USP2POLBALDH1A1PKMHTT
SCHEMBL24344827 0.72 USP2 (0.32) USP2POLBALDH1A1HSD17B10PKM
SCHEMBL4634848 0.71 ALDH1A1 (0.40) ALDH1A1SMN1; SMN2CYP2C9LMNAMAPT
SCHEMBL733206 0.71 CHRNB2 (0.62) USP2SMN1; SMN2CYP2C9CYP2C19CYP1A2
SCHEMBL20104061 0.70 ALOX5 (0.45) ALDH1A1HTTRECQLMAPTKMT2A
SCHEMBL19750772 0.69 CYP2C9 (0.55) USP2ALDH1A1HSD17B10PKMHTT

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-9540392-B2 Thienopyrimidines BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2017-01-10 US disclosed
US-9540392-B2 Thienopyrimidines BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2017-01-10 US disclosed
EP-2852596-B1 THIENOPYRIMIDINES Bayer Pharma AG (DE) 2016-06-22 EP disclosed
US-20150133425-A1 THIENOPYRIMIDINES BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2015-05-14 US disclosed
US-20150133425-A1 THIENOPYRIMIDINES BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2015-05-14 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-20150133425-A1 THIENOPYRIMIDINES TYMP, DPYD, TYMS USP2 4356/4885POLB 132/4885ALDH1A1 469/4885

“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.