SCHEMBL2552834

SCHEMBL2552834

CCc1nc2ccccc2cc1C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GABRP O00591 1/20 0.50
GABRD O14764 1/20 0.50
GABRA1 P14867 1/20 0.50
GABRB1 P18505 1/20 0.50
GABRG2 P18507 1/20 0.50
GABRB3 P28472 1/20 0.50
GABRA5 P31644 1/20 0.50
GABRA3 P34903 1/20 0.50
GABRA2 P47869 1/20 0.50
GABRB2 P47870 1/20 0.50
GABRA4 P48169 1/20 0.50
GABRE P78334 1/20 0.50
GABRA6 Q16445 1/20 0.50
GABRG1 Q8N1C3 1/20 0.50
GABRG3 Q99928 1/20 0.50
GABRQ Q9UN88 1/20 0.50
MEN1 O00255 3/20 0.49
KMT2A Q03164 3/20 0.49
NPC1 O15118 3/20 0.49
RAB9A P51151 3/20 0.49

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
SCHEMBL12501517 0.87 GABRP (0.47) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL17427768 0.87 IKBKB (0.46) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL17339728 0.85 IKBKB (0.45) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL11431563 0.84 IKBKB (0.42) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL28559696 0.83 SMN1; SMN2 (0.41) MEN1KMT2ANPC1RAB9AKDM4E
SCHEMBL634174 0.83 KDM4E (0.58) MEN1KMT2ANPC1RAB9AKDM4E
SCHEMBL9632112 0.83 RAB9A (0.52) GABRPGABRDGABRA1GABRB1GABRG2
SCHEMBL29248333 0.81 KDM4E (0.44) MEN1KMT2ANPC1RAB9AKDM4E
SCHEMBL11548945 0.80 KDM4E (0.43) MEN1KMT2ANPC1RAB9AKDM4E
SCHEMBL17747457 0.80 GABRP (0.46) GABRPGABRDGABRA1GABRB1GABRG2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115697975-A Herbicidal cinnoline derivatives 先正达农作物保护股份公司 2023-02-03 CN disclosed
US-20160009652-A1 SMALL-MOLECULE MODULATORS OF MELANIN EXPRESSION UNIV ROCHESTER (US) 2016-01-14 US disclosed
US-9212205-B2 Nucleic acid binding compounds and methods of use UNIVERSITY OF ROCHESTER (US) 2015-12-15 US disclosed
US-9212205-B2 Nucleic acid binding compounds and methods of use UNIVERSITY OF ROCHESTER (US) 2015-12-15 US disclosed
US-9212205-B2 Nucleic acid binding compounds and methods of use UNIVERSITY OF ROCHESTER (US) 2015-12-15 US disclosed
US-9162984-B2 Small-molecule modulators of melanin expression UNIVERSITY OF ROCHESTER (US) 2015-10-20 US disclosed
EP-2552207-A1 SWEET FLAVOR MODIFIER Senomyx, Inc. (US) 2013-02-06 EP disclosed
WO-2011123693-A1 SWEET FLAVOR MODIFIER SENOMYX, INC. (US) 2011-10-06 WO disclosed
US-20100266677-A1 NUCLEIC ACID BINDING COMPOUNDS AND METHODS OF USE UNIVERSITY OF ROCHESTER (US) 2010-10-21 US disclosed
US-20100266677-A1 NUCLEIC ACID BINDING COMPOUNDS AND METHODS OF USE UNIVERSITY OF ROCHESTER (US) 2010-10-21 US disclosed
WO-2009015384-A1 NUCLEIC ACID BINDING COMPOUNDS AND METHODS OF USE UNIVERSITY OF ROCHESTER (US) 2009-01-29 WO disclosed
WO-2009015384-A1 NUCLEIC ACID BINDING COMPOUNDS AND METHODS OF USE UNIVERSITY OF ROCHESTER (US) 2009-01-29 WO disclosed
WO-2008121850-A2 SMALL-MOLECULE MODULATORS OF MELANIN EXPRESSION UNIVERSITY OF ROCHESTER (US) 2008-10-09 WO disclosed
US-20070167493-A1 Novel compounds for the management of aging-related and diabetic vascular complications, process for their preparation, therapeutic and cosmetic uses thereof TORRENT PHARMACEUTICALS LTD. 2007-07-19 US disclosed
US-7223777-B2 Compounds for the management of aging-related and diabetic vascular complications, process for their preparation, therapeutic and cosmetic uses thereof TORRENT PHARMACEUTICALS LTD. (IN) 2007-05-29 US disclosed
EP-1373263-B1 HETEROCYCLIC COMPOUNDS FOR AGING-RELATED AND DIABETIC VASCULAR COMPLICATIONS TORRENT PHARMACEUTICALS LTD (IN) 2004-10-27 EP disclosed
WO-2002085897-A9 HETEROCYCLIC COMPOUNDS FOR AGING-RELATED AND DIABETIC VASCULAR COMPLICATIONS SANKARANARAYANAN ALANGUDI (IN) 2004-04-01 WO disclosed
US-20030045554-A1 Novel compounds for the management of aging-related and diabetic vascular complications, process for their preparation, therapeutic and cosmetic uses thereof TORRENT PHARMACEUTICALS LTD. 2003-03-06 US disclosed
EP-0070767-B1 QUINOLINE DERIVATIVES, THEIR SALTS, THEIR PREPARATION, THEIR USE AS MEDICINES AND COMPOSITIONS CONTAINING THEM ROUSSEL-UCLAF (FR) 1985-04-10 EP disclosed
EP-0070767-A1 Quinoline derivatives, their salts, their preparation, their use as medicines and compositions containing them ROUSSEL-UCLAF (FR) 1983-01-26 EP 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 (4 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-20160009652-A1 SMALL-MOLECULE MODULATORS OF MELANIN EXPRESSION TYR, MITF, MC1R GABRP 560/4885GABRD 3216/4885GABRA1 2175/4885
US-20100266677-A1 NUCLEIC ACID BINDING COMPOUNDS AND METHODS OF USE SLIRP, HNRNPF, SUB1 GABRP 3617/4885GABRD 2435/4885GABRA1 3720/4885
US-20030045554-A1 Novel compounds for the management of aging-related and diabetic vascular complications, process for their preparation, therapeutic and cosmetic uses thereof AGER, GLA, F12 GABRP 4629/4885GABRD 4643/4885GABRA1 4055/4885
US-20070167493-A1 Novel compounds for the management of aging-related and diabetic vascular complications, process for their preparation, therapeutic and cosmetic uses thereof AGER, GLA, F12 GABRP 4399/4885GABRD 4476/4885GABRA1 3951/4885

“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.