SCHEMBL9696015

SCHEMBL9696015

O=C(O)c1ccc2c(C(=O)O)c1c1cccc2c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD17B10 Q99714 4/20 0.58
MEN1 O00255 4/20 0.58
KMT2A Q03164 4/20 0.58
KDM4E B2RXH2 4/20 0.58
ALDH1A1 P00352 4/20 0.58
CYP1A2 P05177 3/20 0.58
HPGD P15428 2/20 0.58
GLA P06280 1/20 0.58
CYP2C19 P33261 1/20 0.58
PTPN1 P18031 1/20 0.50
GRIN2D O15399 1/20 0.46
GRIN2A Q12879 1/20 0.46
GRIN2B Q13224 1/20 0.46
GRIN2C Q14957 1/20 0.46
NR4A1 P22736 1/20 0.44
NR4A2 P43354 1/20 0.44
NR4A3 Q92570 1/20 0.44
CDC25B P30305 2/20 0.43
ME2 P23368 1/20 0.42
ME1 P48163 1/20 0.42

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
SCHEMBL69796 0.91 ALDH1A1 (0.67) HSD17B10MEN1KMT2AKDM4EALDH1A1
Hydrochloric Acid SCHEMBL8854745 0.90 ALDH1A1 (0.65) HSD17B10MEN1KMT2AKDM4EALDH1A1
SCHEMBL9174392 0.81 HSD17B10 (0.47) HSD17B10MEN1KMT2AKDM4EALDH1A1
SCHEMBL8897686 0.81 HSD17B10 (0.45) HSD17B10MEN1KMT2AKDM4EALDH1A1
SCHEMBL8896289 0.81 HSD17B10 (0.45) HSD17B10MEN1KMT2AKDM4EALDH1A1
SCHEMBL2270685 0.81 HSD17B10 (0.50) HSD17B10MEN1KMT2AKDM4EALDH1A1
SCHEMBL11050089 0.81 NR4A1 (0.56) HSD17B10MEN1KMT2AKDM4EALDH1A1
SCHEMBL580215 0.79 KDM4E (0.59) HSD17B10MEN1KMT2AKDM4EALDH1A1
SCHEMBL29393911 0.78 KMT2A (0.45) HSD17B10MEN1KMT2AKDM4EALDH1A1
SCHEMBL10813708 0.78 KMT2A (0.45) HSD17B10MEN1KMT2AKDM4EALDH1A1

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
US-20160060434-A1 STABILIZATION OF POLYAMIDE WITH COPPER-BASED METAL ORGANIC FRAMEWORKS BASF SE (DE) 2016-03-03 US disclosed
US-5091497-A HEAT-CURING POLYETHER-POLYESTER-POLYURETHANE UREAS BAYER AKTIENGESELLSCHAFT (DE) 1992-02-25 US disclosed
US-4847321-A SEALING, STORAGE STABILITY BAYER AKTIENGESELLSCHAFT (DE) 1989-07-11 US disclosed
US-4801623-A FROM POLYISOCYANATE WITH URETDIONE GROUPS AND POLYBASIC CARBOXYLIC ACID BAYER AKTIENGESELLSCHAFT (DE) 1989-01-31 US disclosed
EP-0122949-B1 HEAT-DURABLE SPUN-LIKE FASCIATED YARN AND METHOD FOR PRODUCING THE SAME TEIJIN LIMITED (JP) 1987-07-08 EP disclosed
US-4619985-A Process for the production of deactivated suspensions of finely-divided polyisocyanates in relatively high molecular weight compounds, deactivated suspensions and use thereof for the production of polyurethanes BAYER AKTIENGESELLSCHAFT (DE) 1986-10-28 US disclosed
US-4569982-A POLYETHER AMINES AND POLYESTERAMINES; HARD AND SOFT SEGMENTS BAYER AKTIENGESELLSCHAFT (DE) 1986-02-11 US disclosed
US-4505100-A Heat-durable spun-like fasciated yarn and method for producing the same TEIJIN LIMITED (JP) 1985-03-19 US disclosed
US-4483974-A POLYMERIZATION INHIGITION BY BLOCKING WITH AMINE, HYDRAZINE, OR HYDRAZIDE BAYER AKTIENGESELLSCHAFT (DE) 1984-11-20 US disclosed
EP-0122949-A1 Heat-durable spun-like fasciated yarn and method for producing the same TEIJIN LIMITED (JP) 1984-10-31 EP disclosed
US-4442280-A STORAGE STABILITY BAYER AKTIENGESELLSCHAFT (DE) 1984-04-10 US disclosed