SCHEMBL19082961

SCHEMBL19082961

Cc1nc(NCc2ccco2)c2cc[nH]c2n1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 11/20 0.54
LMNA P02545 8/20 0.54
HTT P42858 8/20 0.54
ALDH1A1 P00352 7/20 0.54
MAPK1 P28482 6/20 0.54
HPGD P15428 3/20 0.54
KMT2A Q03164 7/20 0.51
MEN1 O00255 5/20 0.51
PKM P14618 1/20 0.51
HSD17B10 Q99714 1/20 0.51
MAPT P10636 7/20 0.48
KDM4E B2RXH2 6/20 0.48
BLM P54132 1/20 0.48
POLB P06746 3/20 0.47
CYP1A2 P05177 2/20 0.47
TSHR P16473 2/20 0.47
CYP3A4 P08684 1/20 0.47
CYP2D6 P10635 1/20 0.47
CYP2C9 P11712 1/20 0.47
CYP2C19 P33261 1/20 0.47

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
SCHEMBL20119352 0.84 SMN1; SMN2 (0.59) SMN1; SMN2LMNAHTTALDH1A1MAPK1
SCHEMBL19064634 0.81 POLB (0.65) SMN1; SMN2LMNAHTTALDH1A1MAPK1
SCHEMBL19082963 0.80 NPY5R (0.49) SMN1; SMN2LMNAHTTALDH1A1MAPK1
SCHEMBL20119913 0.78 POLB (0.66) SMN1; SMN2LMNAHTTALDH1A1MAPK1
SCHEMBL16146496 0.78 SMN1; SMN2 (0.53) SMN1; SMN2LMNAHTTALDH1A1MAPK1
SCHEMBL19082962 0.78 CLK2 (0.39) SMN1; SMN2LMNAHTTALDH1A1MAPK1
Rolodine SCHEMBL121916 0.78 NPY5R (0.49) SMN1; SMN2LMNAALDH1A1MAPK1KMT2A
Hydrochloric Acid SCHEMBL22346221 0.77 POLB (0.64) SMN1; SMN2LMNAHTTALDH1A1MAPK1
SCHEMBL19082946 0.77 ADORA2A (0.40) SMN1; SMN2LMNAHTTALDH1A1MAPK1
SCHEMBL22224126 0.76 SMN1; SMN2 (0.54) SMN1; SMN2LMNAHTTALDH1A1MAPK1

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 SMN1; SMN2 87/4885LMNA 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.