SCHEMBL19082950

SCHEMBL19082950

Cc1nc(NCc2cnc(CO)cn2)c2cc[nH]c2n1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.39
LMNA P02545 2/20 0.39
HTT P42858 1/20 0.39
CYP1A2 P05177 11/20 0.37
CYP3A4 P08684 11/20 0.37
CYP2D6 P10635 7/20 0.37
ALDH1A1 P00352 6/20 0.37
HSD17B10 Q99714 5/20 0.37
CLK4 Q9HAZ1 4/20 0.37
MEN1 O00255 4/20 0.37
KMT2A Q03164 4/20 0.37
USP2 O75604 3/20 0.37
NUDT1 P36639 1/20 0.36
SYK P43405 1/20 0.36
CYP2C19 P33261 5/20 0.34
KDM4E B2RXH2 3/20 0.34
SMN1; SMN2 Q16637 3/20 0.34
HPGD P15428 2/20 0.34
TP53 P04637 2/20 0.34
MAPT P10636 2/20 0.34

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
SCHEMBL19082956 0.88 CYP1A2 (0.47) TSHRLMNAHTTCYP1A2CYP3A4
SCHEMBL19082947 0.86 LMNA (0.36) TSHRLMNAHTTCLK4NUDT1
SCHEMBL19082945 0.82 LMNA (0.44) TSHRLMNAHTTCYP1A2CYP3A4
SCHEMBL17017332 0.81 CYP1A2 (0.38) TSHRLMNAHTTCYP1A2CYP3A4
SCHEMBL29829338 0.81 CYP1A2 (0.38) TSHRLMNAHTTCYP1A2CYP3A4
SCHEMBL19082958 0.80 HDAC6 (0.52) HDAC6
SCHEMBL19082959 0.80 LMNA (0.36) TSHRLMNAHTTCLK4NUDT1
SCHEMBL17017341 0.78 IGF1R (0.34) TSHRLMNAHTTCYP1A2CYP3A4
SCHEMBL19082962 0.77 CLK2 (0.39) TSHRLMNAHTTALDH1A1CLK4
Rolodine SCHEMBL121916 0.74 NPY5R (0.49) LMNACYP3A4ALDH1A1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20170190704-A1 COMPOSITIONS AND METHODS USING THE SAME FOR TREATMENT OF NEURODEGENERATIVE AND MITOCHONDRIAL DISEASE Mitokinin, LLC (US) 2017-07-06 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-20170190704-A1 COMPOSITIONS AND METHODS USING THE SAME FOR TREATMENT OF NEURODEGENERATIVE AND MITOCHONDRIAL DISEASE NLN, HAGH, MT-ND2 TSHR 4608/4885LMNA 1132/4885HTT 96/4885

“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.