SCHEMBL362270

SCHEMBL362270

Cc1ccc(-c2nc3ncccc3nc2Cl)cc1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.66
MAPK14 Q16539 3/20 0.49
KDM4E B2RXH2 3/20 0.46
PKM P14618 1/20 0.46
ALDH1A1 P00352 5/20 0.45
TDP1 Q9NUW8 1/20 0.45
MAPT P10636 2/20 0.43
MAPK1 P28482 1/20 0.43
HTT P42858 1/20 0.43
SMN1; SMN2 Q16637 1/20 0.43
NPSR1 Q6W5P4 1/20 0.43
BCHE P06276 1/20 0.41
ACHE P22303 1/20 0.41
DHODH Q02127 3/20 0.39
POLB P06746 1/20 0.39
RAB9A P51151 1/20 0.39
ADORA2A P29274 1/20 0.39
SYK P43405 1/20 0.38
AURKB Q96GD4 1/20 0.38
INCENP Q9NQS7 1/20 0.38

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
SCHEMBL360643 0.87 MAPK14 (0.62) L3MBTL1MAPK14KDM4EALDH1A1TDP1
SCHEMBL362622 0.85 KDM4E (0.65) L3MBTL1MAPK14KDM4EPKMALDH1A1
SCHEMBL362378 0.83 TDP1 (0.69) L3MBTL1MAPK14KDM4EALDH1A1TDP1
SCHEMBL360913 0.83 TDP1 (0.69) L3MBTL1MAPK14KDM4EALDH1A1TDP1
SCHEMBL13020043 0.81 TDP1 (0.67) L3MBTL1MAPK14KDM4EALDH1A1TDP1
SCHEMBL21174607 0.79 MAPK14 (0.44) L3MBTL1MAPK14KDM4EPKMTDP1
SCHEMBL362277 0.75 TDP1 (0.54) MAPK14KDM4EPKMALDH1A1TDP1
SCHEMBL14764526 0.73 BCHE (0.41) L3MBTL1MAPK14ALDH1A1TDP1BCHE
SCHEMBL21174590 0.72 RAD51 (0.48) MAPK14KDM4EPKMALDH1A1RAB9A
SCHEMBL904495 0.71 SYK (0.47) L3MBTL1KDM4EALDH1A1TDP1MAPT

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
EP-2593452-B1 IP RECEPTOR AGONIST HETEROCYCLIC COMPOUNDS NOVARTIS AG (CH) 2017-01-18 EP disclosed
US-9132127-B2 Substituted pyrido[2,3-B]pyrazines as IP receptor agonists NOVARTIS AG (CH) 2015-09-15 US disclosed
US-20140243346-A1 IP RECEPTOR AGONIST HETEROCYCLIC COMPOUNDS NOVARTIS AG (CH) 2014-08-28 US disclosed
US-8754085-B2 Pyrido[2,3-b]pyrazine compounds useful as IP receptor agonist NOVARTIS AG (CH) 2014-06-17 US disclosed
EP-2593452-A1 IP RECEPTOR AGONIST HETEROCYCLIC COMPOUNDS Novartis AG (CH) 2013-05-22 EP disclosed
US-20130102611-A1 IP RECEPTOR AGONIST HETEROCYCLIC COMPOUNDS NOVARTIS AG (CH) 2013-04-25 US disclosed
WO-2012007539-A9 IP RECEPTOR AGONIST HETEROCYCLIC COMPOUNDS NOVARTIS AG (CH) 2012-11-01 WO disclosed
WO-2012007539-A1 IP RECEPTOR AGONIST HETEROCYCLIC COMPOUNDS NOVARTIS AG (CH) 2012-01-19 WO 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-20140243346-A1 IP RECEPTOR AGONIST HETEROCYCLIC COMPOUNDS PTGIR, ACVR1, PTGFR L3MBTL1 4875/4885MAPK14 894/4885KDM4E 3335/4885
US-20130102611-A1 IP RECEPTOR AGONIST HETEROCYCLIC COMPOUNDS PTGIR, ACVR1, PTGFR L3MBTL1 4875/4885MAPK14 894/4885KDM4E 3335/4885

“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.