SCHEMBL3369458

SCHEMBL3369458

Cn1cncc1C(=O)c1ccc(Cl)cc1

nearest known ligand 0.55

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.55
NPC1 O15118 3/20 0.46
RAB9A P51151 3/20 0.46
HRH3 Q9Y5N1 8/20 0.44
SRD5A2 P31213 1/20 0.43
MAPK1 P28482 1/20 0.43
GSK3B P49841 1/20 0.43
DYRK1A Q13627 1/20 0.43
HPGD P15428 1/20 0.42
IDO1 P14902 1/20 0.42
PRNP P04156 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40

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
SCHEMBL15202096 0.85 ALDH1A1 (0.50) HTTNPC1RAB9ASRD5A2GSK3B
SCHEMBL13461742 0.85 HTT (0.47) HTTNPC1RAB9ASRD5A2MAPK1
SCHEMBL15201466 0.84 HRH3 (0.45) HTTNPC1RAB9AHRH3SMN1; SMN2
SCHEMBL15201354 0.83 LTA4H (0.49) NPC1RAB9AHRH3MAPK1GSK3B
SCHEMBL15648234 0.83 CYP19A1 (0.42) HTTNPC1RAB9AHPGDIDO1
SCHEMBL15201717 0.83 LMNA (0.49) HTTNPC1RAB9AHRH3MAPK1
SCHEMBL15646669 0.83 MAPT (0.49) HTTNPC1IDO1
SCHEMBL1045351 0.83 MEN1 (0.46) HTTSRD5A2MAPK1IDO1
SCHEMBL15201239 0.83 SRD5A2 (0.46) HTTNPC1RAB9ASRD5A2HPGD
SCHEMBL5550351 0.83 NAPRT (0.49) HTTNPC1RAB9ASMN1; SMN2

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 109 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2814814-B1 IMIDAZOLYLKETONE DERIVATIVES ASD ALDOSTERONE SYNTHASE INHIBITORS HOFFMANN LA ROCHE (CH) 2019-05-08 EP claimed
US-9464058-B2 Imidazolylketone derivatives HOFFMANN-LA ROCHE INC. (US) 2016-10-11 US claimed
EP-3057950-B1 PHENYL LINKED QUINOLINYL MODULATORS OF ROR-GAMMA-T JANSSEN PHARMACEUTICA NV (BE) 2020-12-02 EP disclosed
EP-3057951-B1 METHYLENE LINKED QUINOLINYL MODULATORS OF ROR-GAMMA-T JANSSEN PHARMACEUTICA NV (BE) 2019-11-20 EP disclosed
US-10369146-B2 Phenyl linked quinolinyl modulators of RORγt JANSSEN PHARMACEUTICA NV (BE) 2019-08-06 US disclosed
US-10369146-B2 Phenyl linked quinolinyl modulators of RORγt JANSSEN PHARMACEUTICA NV (BE) 2019-08-06 US disclosed
EP-3057422-B1 QUINOLINYL MODULATORS OF ROR(GAMMA)T JANSSEN PHARMACEUTICA NV (BE) 2019-05-15 EP disclosed
EP-2814814-B1 IMIDAZOLYLKETONE DERIVATIVES ASD ALDOSTERONE SYNTHASE INHIBITORS HOFFMANN LA ROCHE (CH) 2019-05-08 EP disclosed
EP-2814814-B1 IMIDAZOLYLKETONE DERIVATIVES ASD ALDOSTERONE SYNTHASE INHIBITORS HOFFMANN LA ROCHE (CH) 2019-05-08 EP disclosed
US-10201546-B2 Quinolinyl modulators of RORγt JANSSEN PHARMACEUTICA NV (BE) 2019-02-12 US disclosed
US-10201546-B2 Quinolinyl modulators of RORγt JANSSEN PHARMACEUTICA NV (BE) 2019-02-12 US disclosed
WO-2005105783-A1 DIASTEREOSELECTIVE SYNTHESIS PROCESS WITH 6-BROMO-4-(3-CHLOROPHENYL)-2-METHOXY-QUINOLINE JANSSEN PHARMACEUTICA N.V. (BE) 2005-11-10 WO disclosed
US-6844357-B2 Substituted quinolin-2-one derivatives useful as antiproliferative agents PFIZER INC. (US) 2005-01-18 US disclosed
US-20040067968-A1 Farnesyl transferase inhibiting 4-heterocyclyl quinoline and quinazoline JANSSEN PHARMACEUTICA, N.V. (BE) 2004-04-08 US disclosed
EP-1351954-A1 FARNESYL TRANSFERASE INHIBITING 4-HETEROCYCLYL-QUINOLINE AND QUINAZOLINE DERIVATIVES JANSSEN PHARMACEUTICA N.V. (BE) 2003-10-15 EP disclosed
US-20030166675-A1 Substituted quinolin-2-one derivatives useful as antiproliferative agents PFIZER INC. 2003-09-04 US disclosed
US-20020156113-A1 Farnesyl transferase inhibitors; anticancer agents LES LABORATOIRES SERVIER (FR) 2002-10-24 US disclosed
WO-2002057258-A1 CYCLO`D!AZEPANE DERIVATIVES WHICH ARE USED AS FARNESYLTRANSFERASE INHIBITORS AND METHOD FOR THE PREPARATION THEREOF LES LABORATOIRES SERVIER (FR) 2002-07-25 WO disclosed
EP-1225170-A2 Cycloheptene compounds, process for their preparation and pharmaceutical compositions containing them Les Laboratoires Servier S.A. (FR) 2002-07-24 EP disclosed
WO-2002051834-A1 FARNESYL TRANSFERASE INHIBITING 4-HETEROCYCLYL-QUINOLINE AND QUINAZOLINE DERIVATIVES JANSSEN PHARMACEUTICA N.V. (BE) 2002-07-04 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 (5 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-10369146-B2 Phenyl linked quinolinyl modulators of RORγt RORC, RORB, RORA HTT 1803/4885NPC1 2216/4885RAB9A 177/4885
US-20020156113-A1 Farnesyl transferase inhibitors; anticancer agents COASY, FNTA, FNTB HTT 4285/4885NPC1 30/4885RAB9A 755/4885
US-20030166675-A1 Substituted quinolin-2-one derivatives useful as antiproliferative agents CCNA1, NRAS, CCNA2 HTT 2745/4885NPC1 1182/4885RAB9A 399/4885
US-20040067968-A1 Farnesyl transferase inhibiting 4-heterocyclyl quinoline and quinazoline FNTA, FNTB, ACAT2 HTT 4526/4885NPC1 67/4885RAB9A 183/4885
US-10201546-B2 Quinolinyl modulators of RORγt RORC, RORB, RORA HTT 2241/4885NPC1 2137/4885RAB9A 129/4885

“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.