SCHEMBL3766255

SCHEMBL3766255

Cc1ccccc1Cc1nc2ccc(B3OC(C)(C)C(C)(C)O3)cc2[nH]1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 2/20 0.49
GAA P10253 5/20 0.42
KMT2A Q03164 2/20 0.42
MEN1 O00255 1/20 0.42
ALDH1A1 P00352 1/20 0.42
THRB P10828 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
PKM P14618 3/20 0.41
TSHR P16473 1/20 0.41
MAPT P10636 2/20 0.40
KDM4E B2RXH2 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
RIPK1 Q13546 1/20 0.40
CHEK2 O96017 1/20 0.39
GRIN1 Q05586 1/20 0.38
GRIN2B Q13224 1/20 0.38
ERBB2 P04626 1/20 0.38
IGF1R P08069 1/20 0.37
LPL P06858 1/20 0.37
LIPG Q9Y5X9 1/20 0.37

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
SCHEMBL3762832 0.88 LMNA (0.44) EGFRGAAPKMTSHRMAPT
SCHEMBL3761817 0.87 GAA (0.55) EGFRGAAALDH1A1PKMTSHR
SCHEMBL3764982 0.86 POLB (0.43) EGFRKMT2AMEN1ALDH1A1TSHR
SCHEMBL3760873 0.86 PDE10A (0.37) EGFRGAAKMT2APKMTSHR
SCHEMBL14327029 0.78 GAA (0.52) EGFRGAAKMT2APKMTSHR
SCHEMBL15574354 0.76 ALDH1A1 (0.49) GAAKMT2AMEN1ALDH1A1PKM
SCHEMBL4119398 0.74 EGFR (0.74) EGFRGAAKMT2AMEN1ALDH1A1
SCHEMBL12647775 0.74 KMT2A (0.40) KMT2AMEN1ALDH1A1L3MBTL1PKM
SCHEMBL3765301 0.73 NPC1 (0.52) GAAKMT2AMEN1ALDH1A1TSHR
SCHEMBL3301830 0.73 LPL (0.38) EGFRRIPK1LPLLIPGLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2435435-B1 PYRIMIDINE INHIBITORS OF KINASE ACTIVITY ABBVIE INC (US) 2014-01-29 EP disclosed
US-8536180-B2 Pyrimidine inhibitors of kinase activity ABBVIE INC. (US) 2013-09-17 US disclosed
US-20100305118-A1 PYRIMIDINE INHIBITORS OF KINASE ACTIVITY ABBOTT LABORATORIES (US) 2010-12-02 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-20100305118-A1 PYRIMIDINE INHIBITORS OF KINASE ACTIVITY IGF1R, TK1, CDK2 EGFR 249/4885GAA 2232/4885KMT2A 2972/4885

“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.