SCHEMBL9635664

SCHEMBL9635664

O=C(c1cccnc1C(=O)O)c1cccnc1C(=O)O

nearest known ligand 0.80

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 11/20 0.80
ALDH1A1 P00352 6/20 0.80
MAPT P10636 2/20 0.80
ALOX15 P16050 2/20 0.80
CYP3A4 P08684 1/20 0.80
TSHR P16473 1/20 0.80
BLM P54132 1/20 0.80
AGER Q15109 1/20 0.80
NPSR1 Q6W5P4 1/20 0.80
L3MBTL1 Q9Y468 1/20 0.80
TDP1 Q9NUW8 1/20 0.57
NAPRT Q6XQN6 2/20 0.53
LMNA P02545 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
CYP1A2 P05177 1/20 0.53
GAA P10253 2/20 0.53
KMT2A Q03164 1/20 0.50
MYC P01106 2/20 0.49
ASPH Q12797 2/20 0.47
KDM8 Q8N371 2/20 0.47

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
Quinolinic Acid SCHEMBL29356188 0.89 KDM4E (1.00) KDM4EALDH1A1MAPTALOX15CYP3A4
Quinolinic Acid SCHEMBL27676801 0.89 KDM4E (1.00) KDM4EALDH1A1MAPTALOX15CYP3A4
Quinolinic Acid SCHEMBL69230 0.89 KDM4E (1.00) KDM4EALDH1A1MAPTALOX15CYP3A4
Quinolinic Acid SCHEMBL343618 0.89 KDM4E (1.00) KDM4EALDH1A1MAPTALOX15CYP3A4
SCHEMBL296670 0.88 KDM4E (0.69) KDM4EALDH1A1MAPTALOX15CYP3A4
SCHEMBL7851627 0.88 KDM4E (0.62) KDM4EALDH1A1MAPTALOX15CYP3A4
Quinolinic Acid SCHEMBL3744925 0.87 KDM4E (0.96) KDM4EALDH1A1MAPTALOX15CYP3A4
Quinolinic Acid SCHEMBL5361020 0.87 KDM4E (0.96) KDM4EALDH1A1MAPTALOX15CYP3A4
Quinolinic Acid SCHEMBL21326209 0.87 KDM4E (0.96) KDM4EALDH1A1MAPTALOX15CYP3A4
Quinolinic Acid SCHEMBL5674125 0.87 KDM4E (0.96) KDM4EALDH1A1MAPTALOX15CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5164470-A Polymer compositions SHELL OIL COMPANY (US) 1992-11-17 US disclosed
US-5149823-A Sulfonamide substituted spirodilactams SHELL OIL COMPANY (US) 1992-09-22 US disclosed
US-5145910-A Ketocarboxylated polymers SHELL OIL COMPANY (US) 1992-09-08 US disclosed
US-5112938-A CYANO- AND CARBOXY-SUBSTITUTED SPIRODILACTAMS SHELL OIL COMPANY (US) 1992-05-12 US disclosed
US-5103001-A SPIRODILACTAMS SHELL OIL COMPANY (US) 1992-04-07 US disclosed
US-5093495-A Benzoheterocyclic compounds SHELL OIL COMPANY (US) 1992-03-03 US disclosed
US-5093465-A Polyamide containing spirodilactam moieties SHELL OIL COMPANY (US) 1992-03-03 US disclosed
US-5093499-A Spirodilactam derivatives SHELL OIL COMPANY (US) 1992-03-03 US disclosed
US-5071996-A Benzheterocyclic compounds SHELL OIL COMPANY (US) 1991-12-10 US disclosed
US-5061780-A Poly(ether-bis-imide-spiro dilactam) polymer SHELL OIL COMPANY (US) 1991-10-29 US disclosed
US-4968770-A Polyamide from spirodilactam precursor and primary diamine SHELL OIL COMPANY (US) 1990-11-06 US disclosed
US-4968812-A Spirolactonelactams SHELL OIL COMPANY (US) 1990-11-06 US disclosed
US-4940801-A Spirodilactam derivatives SHELL OIL COMPANY (US) 1990-07-10 US disclosed
US-4939251-A Novel spirolactones SHELL OIL COMPANY (US) 1990-07-03 US disclosed
US-4927906-A Novel polyamideimide polymers SHELL OIL COMPANY (US) 1990-05-22 US disclosed
US-4908458-A 1,5-Di(benzoheterocyclic)-3-oxopentane derivatives SHELL OIL COMPANY (US) 1990-03-13 US disclosed
US-4885351-A Spirodilactam derivatives SHELL OIL COMPANY (US) 1989-12-05 US disclosed
US-4747875-A Chromogenic azaphthalide compound and a colour-forming recording composition containing the same YAMADA CHEMICAL CO., LTD. (JP) 1988-05-31 US disclosed
US-4334072-A CHROMOGENS, LEUCO DYES APPLETON PAPERS INC. (US) 1982-06-08 US disclosed
US-4275206-A CHROMOGENS FOR RECORDING AND MARKING SYSTEMS APPLETON PAPERS INC. (US) 1981-06-23 US disclosed