SCHEMBL3860498

SCHEMBL3860498

Oc1ccc(C=Cc2ccc3ccccc3n2)cc1O

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 4/20 0.69
▸ KDM4E B2RXH2 3/20 0.69
▸ NPC1 O15118 3/20 0.69
▸ MAPT P10636 3/20 0.69
▸ MEN1 O00255 3/20 0.69
▸ KMT2A Q03164 3/20 0.69
▸ LMNA P02545 2/20 0.69
▸ L3MBTL1 Q9Y468 2/20 0.69
▸ SMN1; SMN2 Q16637 2/20 0.69
▸ ALDH1A1 P00352 1/20 0.69
▸ CYSLTR2 Q9NS75 4/20 0.68
▸ CYSLTR1 Q9Y271 4/20 0.68
▸ PKM P14618 1/20 0.63
▸ ECE2 P0DPD6 2/20 0.60
▸ GLA P06280 2/20 0.59
▸ MAPK1 P28482 2/20 0.56
▸ RXFP1 Q9HBX9 1/20 0.56
▸ HTT P42858 1/20 0.54
▸ LCK P06239 1/20 0.53
▸ PIM1 P11309 1/20 0.52

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
SCHEMBL12866125 1.00 RAB9A (0.69) RAB9AKDM4ENPC1MAPTMEN1
SCHEMBL12884278 0.85 RAB9A (0.73) RAB9AKDM4ENPC1MAPTMEN1
SCHEMBL29230091 0.84 KDM4E (0.61) RAB9AKDM4ENPC1MAPTMEN1
SCHEMBL29230090 0.84 KDM4E (0.61) RAB9AKDM4ENPC1MAPTMEN1
SCHEMBL31522348 0.83 RAB9A (0.71) RAB9AKDM4ENPC1MAPTMEN1
SCHEMBL28433887 0.83 GLA (0.78) RAB9AKDM4ENPC1MAPTMEN1
SCHEMBL10036065 0.83 GLA (0.78) RAB9AKDM4ENPC1MAPTMEN1
SCHEMBL28433890 0.83 GLA (0.78) RAB9AKDM4ENPC1MAPTMEN1
SCHEMBL11062170 0.83 GLA (0.78) RAB9AKDM4ENPC1MAPTMEN1
SCHEMBL12894580 0.83 CYSLTR2 (0.68) RAB9AKDM4ENPC1MAPTMEN1

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-20080280849-A1 Synergic Combinations Comprising a Quinoline Compound and Other Hiv Infection Therapeutic Agents CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (C.N.R.S.) (FR) 2008-11-13 — — US claimed
US-6670377-B1 Inhibitory properties of human immunodeficiency virus integrase CENTRE NATIONAL DE LA RECHERCHE (FR) 2003-12-30 — — US claimed
EP-0975597-B1 QUINOLINE DERIVATIVES, HAVING IN PARTICULAR ANTIVIRAL PROPERTIES, PREPARATION AND BIOLOGICAL APPLICATIONS THEREOF CENTRE NAT RECH SCIENT (FR) 2009-09-02 — — EP disclosed
US-20080280849-A1 Synergic Combinations Comprising a Quinoline Compound and Other Hiv Infection Therapeutic Agents CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (C.N.R.S.) (FR) 2008-11-13 — — US disclosed
WO-2006129134-A1 SYNERGIC COMBINATIONS COMPRISING A STYRYLQUINOLINE COMPOUND AND OTHER HIV INFECTION THERAPEUTIC AGENTS BIOALLIANCE PHARMA (FR) 2006-12-07 — — WO disclosed
US-6670377-B1 Inhibitory properties of human immunodeficiency virus integrase CENTRE NATIONAL DE LA RECHERCHE (FR) 2003-12-30 — — US disclosed
EP-0975597-A1 QUINOLINE DERIVATIVES, HAVING IN PARTICULAR ANTIVIRAL PROPERTIES, PREPARATION AND BIOLOGICAL APPLICATIONS THEREOF CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (CNRS) (FR) 2000-02-02 — — EP disclosed
WO-1998045269-A1 QUINOLINE DERIVATIVES, HAVING IN PARTICULAR ANTIVIRAL PROPERTIES, PREPARATION AND BIOLOGICAL APPLICATIONS THEREOF CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (CNRS) (FR) 1998-10-15 — — 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 (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-20080280849-A1 Synergic Combinations Comprising a Quinoline Compound and Other Hiv Infection Therapeutic Agents CTSL, CDKL1, QTRT2 RAB9A 2746/4885KDM4E 2169/4885NPC1 674/4885

“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.

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