SCHEMBL6490997

SCHEMBL6490997

O=c1[nH]c2ccccc2nc1Cc1ccccc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 8/20 1.00
▸ ALDH1A1 P00352 7/20 1.00
▸ HSD17B10 Q99714 5/20 1.00
▸ HPGD P15428 4/20 1.00
▸ GAA P10253 3/20 1.00
▸ HTT P42858 2/20 1.00
▸ NPC1 O15118 5/20 0.74
▸ RAB9A P51151 5/20 0.74
▸ SMN1; SMN2 Q16637 3/20 0.74
▸ KMT2A Q03164 4/20 0.70
▸ MEN1 O00255 3/20 0.70
▸ PKM P14618 1/20 0.70
▸ MAPT P10636 3/20 0.60
▸ POLB P06746 1/20 0.60
▸ L3MBTL1 Q9Y468 1/20 0.60
▸ PLAUR Q03405 1/20 0.53
▸ CYP2C9 P11712 1/20 0.51
▸ LMNA P02545 1/20 0.50
▸ HTR2C P28335 1/20 0.50
▸ TP53 P04637 1/20 0.50

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
SCHEMBL28479646 0.84 KDM4E (0.72) KDM4EALDH1A1HSD17B10HPGDGAA
SCHEMBL19260269 0.81 ALDH1A1 (0.67) KDM4EALDH1A1HSD17B10HPGDGAA
SCHEMBL30164086 0.79 KDM4E (0.70) KDM4EALDH1A1HSD17B10HPGDGAA
SCHEMBL28135101 0.79 KDM4E (0.70) KDM4EALDH1A1HSD17B10HPGDGAA
SCHEMBL13694770 0.79 KDM4E (0.70) KDM4EALDH1A1HSD17B10HPGDGAA
SCHEMBL1905589 0.79 KDM4E (1.00) KDM4EALDH1A1HSD17B10HPGDGAA
SCHEMBL1161820 0.79 KDM4E (0.70) KDM4EALDH1A1HSD17B10HPGDGAA
SCHEMBL29232559 0.79 KDM4E (0.70) KDM4EALDH1A1HSD17B10HPGDGAA
SCHEMBL29992538 0.79 KDM4E (1.00) KDM4EALDH1A1HSD17B10HPGDGAA
SCHEMBL6648776 0.79 NPC1 (0.76) KDM4EALDH1A1HSD17B10HPGDGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116655545-A Synthesis method of 3-benzoyl quinoxaline-2 (1H) -ketone compound 云南铁峰矿业化工新技术有限公司 2023-08-29 — — CN disclosed
CN-113683573-A Preparation method of visible light catalyzed benzylation quinoxalinone compound 郑州大学 2021-11-23 — — CN disclosed
EP-3229811-B1 PREVENTION AND TREATMENT OF INFLAMMATORY CONDITIONS GRI BIO INC (US) 2021-02-24 — — EP disclosed
WO-2016094226-A1 PREVENTION AND TREATMENT OF INFLAMMATORY CONDITIONS GLYCOREGIMMUNE, INC. (US) 2016-06-16 — — WO disclosed
US-20160158258-A1 PREVENTION AND TREATMENT OF INFLAMMATORY CONDITIONS ALTIUM GROWTH FUND, LP 2016-06-09 — — US disclosed
EP-1213288-B1 Propanoic acid derivatives that inhibit the binding of integrins to their receptors ENCYSIVE PHARMACEUTICALS INC (US) 2009-01-14 — — EP disclosed
US-6916805-B2 Quinoxalinones as serine protease inhibitors WARNER-LAMBERT COMPANY LLC (US) 2005-07-12 — — US disclosed
US-20020086866-A1 Quinoxalinones as serine protease inhibitors DUDLEY DANETTE ANDREA (US) 2002-07-04 — — US disclosed
US-6410536-B1 ANTICOAGULANTS WARNER-LAMBERT COMPANY 2002-06-25 — — US disclosed
EP-1068190-A1 QUINOXALINONES AS SERINE PROTEASE INHIBITORS SUCH AS FACTOR XA AND THROMBIN WARNER-LAMBERT COMPANY LLC (US) 2001-01-17 — — EP disclosed
WO-1999050254-A1 QUINOXALINONES AS SERINE PROTEASE INHIBITORS SUCH AS FACTOR XA AND THROMBIN WARNER-LAMBERT COMPANY (US) 1999-10-07 — — 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-20020086866-A1 Quinoxalinones as serine protease inhibitors HABP2, SERPINB1, PRSS1 KDM4E 1273/4885ALDH1A1 1960/4885HSD17B10 1850/4885
US-20160158258-A1 PREVENTION AND TREATMENT OF INFLAMMATORY CONDITIONS RXRA, RXRG, CX3CR1 KDM4E 812/4885ALDH1A1 999/4885HSD17B10 3697/4885

“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.

Send feedback