SCHEMBL8946324

SCHEMBL8946324

COC(=O)c1cc(N)c2c(Cl)cc(Cl)cc2n1

nearest known ligand 0.61

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NQO2 P16083 10/20 0.61
ABL1 P00519 1/20 0.41
KDM4E B2RXH2 2/20 0.40
MAPT P10636 2/20 0.40
ALDH1A1 P00352 1/20 0.40
PKM P14618 1/20 0.40
GAA P10253 1/20 0.39
MRGPRX4 Q96LA9 1/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
KMT2A Q03164 1/20 0.38
SMN1; SMN2 Q16637 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
SCHEMBL29617388 0.85 ALDH1A1 (0.46) NQO2MAPTALDH1A1NPC1RAB9A
SCHEMBL1615754 0.85 ALDH1A1 (0.46) NQO2MAPTALDH1A1NPC1RAB9A
SCHEMBL2905353 0.84 NQO2 (0.56) NQO2KDM4EALDH1A1MRGPRX4
SCHEMBL9462823 0.84 NQO2 (0.75) NQO2ABL1KDM4EMRGPRX4
SCHEMBL9391555 0.82 NQO2 (0.40) NQO2KMT2A
SCHEMBL9462760 0.82 NQO2 (0.64) NQO2KDM4E
SCHEMBL9463012 0.82 NQO2 (0.64) NQO2KDM4EALDH1A1MRGPRX4
SCHEMBL8946290 0.82 NQO2 (0.53) NQO2KDM4EALDH1A1MRGPRX4
SCHEMBL9462812 0.76 NQO2 (0.64) NQO2KDM4EMAPTKMT2A
SCHEMBL14743306 0.75 NQO2 (0.48) NQO2ALDH1A1MRGPRX4KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11130737-B2 Multifunctional aminoquinoline therapeutic agents LOHOCLA RESEARCH CORPORATION (US) 2021-09-28 US disclosed
US-10435371-B2 Multifunctional aminoquinoline therapeutic agent LOHOCLA RESEARCH CORPORATION (US) 2019-10-08 US disclosed
US-10391088-B2 Analgesic compositions LOHOCLA RESEARCH CORPORATION (US) 2019-08-27 US disclosed
US-20190099412-A1 ANALGESIC COMPOSITIONS LOHOCLA RESEARCH CORPORATION 2019-04-04 US disclosed
US-20190092731-A1 MULTIFUNCAIONAL AMINOQUINOLINE THERAPEUTIC AGENT LOHOCLA RESEARCH CORPORATION 2019-03-28 US disclosed
US-20170204064-A1 MULTIFUNCTIONAL AMINOQUINOLINE THERAPEUTIC AGENTS LOHOCLA RESEARCH CORPORATION 2017-07-20 US disclosed
US-20170204064-A1 MULTIFUNCTIONAL AMINOQUINOLINE THERAPEUTIC AGENTS LOHOCLA RESEARCH CORPORATION 2017-07-20 US disclosed
WO-2015195943-A1 MULTIFUNCTIONAL AMINOQUINOLINE THERAPEUTIC AGENTS LOHOCLA RESEARCH CORPORATION (US) 2015-12-23 WO disclosed
US-5493027-A ANTIEPILEPTIC AGENTS, NEUROGENATIVE DISEASES BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 1996-02-20 US disclosed
WO-1994017042-A1 ANTICONVULSIVE AGENTS AND USES THEREOF BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) 1994-08-04 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 (6 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-11130737-B2 Multifunctional aminoquinoline therapeutic agents OPRK1, OPRM1, OPRD1 NQO2 84/4885ABL1 38/4885KDM4E 1097/4885
US-10391088-B2 Analgesic compositions OPRK1, OPRL1, OPRM1 NQO2 742/4885ABL1 1926/4885KDM4E 3189/4885
US-20190099412-A1 ANALGESIC COMPOSITIONS OPRK1, OPRL1, OPRM1 NQO2 742/4885ABL1 1926/4885KDM4E 3189/4885
US-20190092731-A1 MULTIFUNCAIONAL AMINOQUINOLINE THERAPEUTIC AGENT OPRK1, OPRL1, PNMT NQO2 48/4885ABL1 49/4885KDM4E 1720/4885
US-20170204064-A1 MULTIFUNCTIONAL AMINOQUINOLINE THERAPEUTIC AGENTS OPRK1, OPRM1, OPRD1 NQO2 82/4885ABL1 50/4885KDM4E 1838/4885
US-10435371-B2 Multifunctional aminoquinoline therapeutic agent OPRK1, OPRM1, OPRD1 NQO2 92/4885ABL1 53/4885KDM4E 1212/4885

“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.