SCHEMBL334423

SCHEMBL334423

O=C(O)NC(c1ccccc1)c1ccncc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.60
LMNA P02545 3/20 0.60
KMT2A Q03164 2/20 0.59
MEN1 O00255 1/20 0.59
SLC6A9 P48067 2/20 0.52
SLC6A2 P23975 1/20 0.52
SLC6A4 P31645 1/20 0.52
SLC6A3 Q01959 1/20 0.52
ROCK2 O75116 2/20 0.51
ROCK1 Q13464 2/20 0.51
KDM4C Q9H3R0 1/20 0.49
TRPV1 Q8NER1 1/20 0.48
POLB P06746 1/20 0.47
MAPT P10636 1/20 0.47
HPGDS O60760 1/20 0.47
RPS6KA5 O75582 1/20 0.46
MAP4K4 O95819 1/20 0.46
CDK1 P06493 1/20 0.46
CSF1R P07333 1/20 0.46
PRKACA P17612 1/20 0.46

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
SCHEMBL1694742 0.88 LMNA (0.60) ALDH1A1LMNAKMT2AMEN1MAPT
Hydrochloric Acid SCHEMBL5883141 0.86 LMNA (0.58) ALDH1A1LMNAKMT2AMEN1MAPT
SCHEMBL7484882 0.85 ALDH1A1 (0.57) ALDH1A1LMNAKMT2AMEN1SLC6A9
Bromomethane SCHEMBL5883756 0.82 LMNA (0.59) ALDH1A1LMNAKMT2AMEN1MAPT
SCHEMBL11626488 0.81 ALDH1A1 (0.74) ALDH1A1LMNAKMT2AMEN1SLC6A9
SCHEMBL27731701 0.79 HPGDS (0.62) ALDH1A1LMNAKMT2AMEN1SLC6A9
SCHEMBL29902958 0.78 LMNA (0.51) ALDH1A1LMNAKMT2AMEN1MAPT
SCHEMBL5787782 0.77 CNR1 (0.65) ALDH1A1LMNAKMT2AMEN1HPGDS
SCHEMBL20496887 0.75 ALDH1A1 (0.62) ALDH1A1LMNAKMT2AMEN1SLC6A9
SCHEMBL24575947 0.74 HPGDS (0.57) ALDH1A1LMNAKMT2AMEN1HPGDS

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080039490-A1 PYRIDINES FOR TREATING INJURED MAMMALIAN NERVE TISSUE PURDUE RESEARCH FOUNDATION (US) 2008-02-14 US claimed
EP-3331859-B1 BROAD SPECTRUM REACTIVATORS OF OPNA-INHIBITION OF HUMAN CHOLINESTERASES CENTRE NAT RECH SCIENT (FR) 2019-10-02 EP disclosed
EP-3331859-A1 BROAD SPECTRUM REACTIVATORS OF OPNA-INHIBITION OF HUMAN CHOLINESTERASES Centre National De La Recherche Scientifique (FR) 2018-06-13 EP disclosed
WO-2017021319-A1 BROAD SPECTRUM REACTIVATORS OF OPNA-INHIBITION OF HUMAN CHOLINESTERASES CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) 2017-02-09 WO disclosed
US-8729107-B2 Pyridines for treating injured mammalian nerve tissue PURDUE RESEARCH FOUNDATION (US) 2014-05-20 US disclosed
US-8097638-B2 Pyridines for treating injured mammalian nerve tissue PURDUE RESEARCH FOUNDATION (US) 2012-01-17 US disclosed
US-20110130429-A1 PYRIDINES FOR TREATING INJURED MAMMALIAN NERVE TISSUE PURDUE RESEARCH FOUNDATION (US) 2011-06-02 US disclosed
US-20080039490-A1 PYRIDINES FOR TREATING INJURED MAMMALIAN NERVE TISSUE PURDUE RESEARCH FOUNDATION (US) 2008-02-14 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 (2 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-20080039490-A1 PYRIDINES FOR TREATING INJURED MAMMALIAN NERVE TISSUE P2RY4, INA, PMP22 ALDH1A1 298/4885LMNA 2385/4885KMT2A 1451/4885
US-20110130429-A1 PYRIDINES FOR TREATING INJURED MAMMALIAN NERVE TISSUE PMP22, SMN1; SMN2, MUSK ALDH1A1 256/4885LMNA 2624/4885KMT2A 1854/4885

“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.