SCHEMBL3762832

SCHEMBL3762832

CC1(C)OB(c2ccc3nc(Cc4ccccc4Cl)[nH]c3c2)OC1(C)C

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.44
MAPT P10636 3/20 0.44
KDM4E B2RXH2 2/20 0.44
EGFR P00533 6/20 0.41
ERBB2 P04626 3/20 0.41
ALKBH3 Q96Q83 1/20 0.38
GAA P10253 3/20 0.38
PKM P14618 3/20 0.38
TSHR P16473 1/20 0.38
IGF1R P08069 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
RIPK1 Q13546 1/20 0.37
LPL P06858 1/20 0.36
LIPG Q9Y5X9 1/20 0.36
HTT P42858 1/20 0.36
HKDC1 Q2TB90 1/20 0.36
F10 P00742 1/20 0.36

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
SCHEMBL3766255 0.88 EGFR (0.49) LMNAMAPTKDM4EEGFRERBB2
SCHEMBL3760873 0.85 PDE10A (0.37) LMNAMAPTKDM4EEGFRGAA
SCHEMBL3764982 0.85 POLB (0.43) MAPTKDM4EEGFRERBB2TSHR
SCHEMBL3761817 0.84 GAA (0.55) LMNAMAPTKDM4EEGFRERBB2
SCHEMBL15296449 0.77 EGFR (0.40) EGFRSMN1; SMN2LPLLIPG
SCHEMBL14327029 0.74 GAA (0.52) LMNAMAPTKDM4EEGFRERBB2
SCHEMBL2177536 0.73 LMNA (0.64) LMNAMAPTKDM4EEGFRERBB2
SCHEMBL12647775 0.73 KMT2A (0.40) LMNAMAPTKDM4EPKMTDP1
SCHEMBL15574354 0.73 ALDH1A1 (0.49) MAPTKDM4EGAAPKMTDP1
SCHEMBL3765301 0.72 NPC1 (0.52) LMNAMAPTKDM4EGAATSHR

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 LMNA 1836/4885MAPT 2822/4885KDM4E 3417/4885

“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.