SCHEMBL663977

SCHEMBL663977

COC(=O)c1cc(O)nc2ccccc12

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 8/20 0.70
MEN1 O00255 7/20 0.59
KMT2A Q03164 7/20 0.59
ALDH1A1 P00352 7/20 0.58
HPGD P15428 4/20 0.58
TDP1 Q9NUW8 3/20 0.58
PKM P14618 2/20 0.58
MAPK1 P28482 2/20 0.58
POLB P06746 2/20 0.58
LMNA P02545 2/20 0.58
PLIN1 O60240 1/20 0.58
GLA P06280 1/20 0.58
PLIN5 Q00G26 1/20 0.58
MCL1 Q07820 1/20 0.58
ABHD5 Q8WTS1 1/20 0.58
DHODH Q02127 1/20 0.58
USP2 O75604 1/20 0.56
TSHR P16473 3/20 0.53
MAPT P10636 3/20 0.53
PLA2G2A P14555 2/20 0.53

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
SCHEMBL14518623 0.85 MEN1 (0.72) KDM4EMEN1KMT2AALDH1A1HPGD
SCHEMBL72379 0.84 KDM4E (0.70) KDM4EMEN1KMT2AALDH1A1HPGD
SCHEMBL12903095 0.84 KDM4E (0.70) KDM4EMEN1KMT2AALDH1A1HPGD
SCHEMBL31295407 0.84 KDM4E (0.70) KDM4EMEN1KMT2AALDH1A1HPGD
Hydrochloric Acid SCHEMBL4562712 0.83 MEN1 (0.69) KDM4EMEN1KMT2AALDH1A1HPGD
SCHEMBL1229307 0.83 KDM4E (0.68) KDM4EMEN1KMT2AALDH1A1HPGD
SCHEMBL7487026 0.83 KDM4E (0.68) KDM4EMEN1KMT2AALDH1A1HPGD
SCHEMBL17434216 0.83 KDM4E (0.68) KDM4EMEN1KMT2AALDH1A1HPGD
SCHEMBL10120201 0.83 KDM4E (0.68) KDM4EMEN1KMT2AALDH1A1HPGD
SCHEMBL6586825 0.83 KDM4E (0.68) KDM4EMEN1KMT2AALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117447399-A Naphthalene formylhydrazine compound and preparation method and application thereof 上海应用技术大学 2024-01-26 CN claimed
CN-117447399-A Naphthalene formylhydrazine compound and preparation method and application thereof 上海应用技术大学 2024-01-26 CN disclosed
CN-113024551-B Compound extracted and separated from brucea javanica, and preparation method and application thereof 江西中医药大学 2021-08-06 CN disclosed
CN-113024551-A Novel compound extracted and separated from brucea javanica, and preparation method and application thereof 江西中医药大学 2021-06-25 CN disclosed
EP-1838696-B1 NOVEL CYANOGUANIDINE COMPOUNDS LEO PHARMA AS (DK) 2016-03-09 EP disclosed
US-8969573-B2 Compounds for the inhibition of cellular proliferation PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2015-03-03 US disclosed
US-8969573-B2 Compounds for the inhibition of cellular proliferation PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2015-03-03 US disclosed
US-8969573-B2 Compounds for the inhibition of cellular proliferation PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2015-03-03 US disclosed
US-20130178505-A1 Compounds for the Inhibition of Cellular Proliferation PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2013-07-11 US disclosed
US-20130178505-A1 Compounds for the Inhibition of Cellular Proliferation PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) 2013-07-11 US disclosed
EP-1910272-A1 RENIN INHIBITORS Merck Frosst Canada Ltd. (CA) 2008-04-16 EP disclosed
EP-1838696-A1 NOVEL CYANOGUANIDINE COMPOUNDS Leo Pharma A/S (DK) 2007-10-03 EP disclosed
WO-2007009250-A1 RENIN INHIBITORS MERCK FROSST CANADA LTD. (CA) 2007-01-25 WO disclosed
WO-2006066584-A1 NOVEL CYANOGUANIDINE COMPOUNDS LEO PHARMA A/S (DK) 2006-06-29 WO disclosed
US-6583156-B1 Particularly adenosine A2A receptors; neurodegenerative disorders; 2,8-bis(trifluoromethyl)-alpha -(3-thienyl)-4-quinolinemethanol VERNALIS RESEARCH LIMITED (GB) 2003-06-24 US disclosed
CN-1067684-C Imidazo [1,5-1] quinolines for treatment of anxiety and sleep disorders PHAMACIA UPJOHN CO (US) 2001-06-27 CN disclosed
EP-1107760-A2 4-QUINOLINEMETHANOL DERIVATIVES AS PURINE RECEPTOR ANTAGONISTS (I) VERNALIS RESEARCH LIMITED (GB) 2001-06-20 EP disclosed
WO-2000013681-A2 4-QUINOLINEMETHANOL DERIVATIVES AS PURINE RECEPTOR ANTAGONISTS (I) VERNALIS RESEARCH LIMITED (GB) 2000-03-16 WO disclosed
CN-1135753-A Imidazo [1, 5-a ] quinolines for the treatment of anxiety and sleep disorders UPJOHN CO (US) 1996-11-13 CN disclosed
US-4968803-A FLUORINE AS OXIDANT ALLIED-SIGNAL INC. (US) 1990-11-06 US 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-20130178505-A1 Compounds for the Inhibition of Cellular Proliferation MKI67, EIF2AK2, CDK2 KDM4E 2418/4885MEN1 3017/4885KMT2A 3071/4885

“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.