SCHEMBL5022807

SCHEMBL5022807

Oc1cccc(Cc2cccc(O)c2-c2ccccc2)c1-c1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSPA5 P11021 1/20 0.56
AKR1B1 P15121 1/20 0.43
BCL2L1 Q07817 2/20 0.43
ALDH1A1 P00352 2/20 0.43
HPGD P15428 2/20 0.43
HSD17B10 Q99714 2/20 0.43
KEAP1 Q14145 1/20 0.41
HDAC4 P56524 1/20 0.41
HDAC2 Q92769 1/20 0.41
HDAC8 Q9BY41 1/20 0.41
CYP2D6 P10635 2/20 0.40
HIF1A Q16665 2/20 0.40
TSHR P16473 1/20 0.40
BACE1 P56817 3/20 0.40
TAAR1 Q96RJ0 1/20 0.39
BCL2 P10415 1/20 0.39
CYP3A4 P08684 2/20 0.39
CYP1A2 P05177 1/20 0.39
CYP2C9 P11712 1/20 0.39
HSD17B1 P14061 1/20 0.39

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
SCHEMBL8056668 0.90 BCL2 (0.53) HSPA5BCL2L1HPGDHSD17B10KEAP1
SCHEMBL28220947 0.85 PDCD1 (0.50) HSPA5AKR1B1BCL2L1ALDH1A1HPGD
SCHEMBL980893 0.83 GABRA1 (0.50) HSPA5AKR1B1BCL2L1ALDH1A1HPGD
SCHEMBL8858807 0.83 HSPA5 (0.41) HSPA5AKR1B1BCL2L1ALDH1A1HPGD
SCHEMBL27946558 0.83 DPP4 (0.50) HSPA5AKR1B1BCL2L1ALDH1A1HPGD
SCHEMBL4235349 0.83 HSPA5 (0.44) HSPA5BCL2L1ALDH1A1HPGDHSD17B10
Oxirane SCHEMBL28356875 0.82 BCL2 (0.46) HSPA5BCL2L1HPGDHSD17B10KEAP1
SCHEMBL12096897 0.82 BCL2L1 (0.43) HSPA5AKR1B1BCL2L1ALDH1A1HPGD
Potassium SCHEMBL324000 0.82 GABRA1 (0.48) HSPA5AKR1B1BCL2L1HDAC4HDAC2
Ammonia Solution, Strong SCHEMBL324962 0.82 GABRA1 (0.48) HSPA5AKR1B1BCL2L1HDAC4HDAC2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-3965033-A Process for the production of oil-containing microcapsules FUJI PHOTO FILM CO., LTD. (JA) 1976-06-22 US claimed
US-20080312112-A1 Lubricating formulations for dispersancy and temperature, friction, and wear reduction LYON DEVELOPMENT CORPORATION 2008-12-18 US disclosed
US-4766211-A FOR PRESSURE SENSITIVE OR HEAT SENSITIVE RECORDING MATERIALS; LIGHTFASTNESS CIBA-GEIGY CORPORATION (US) 1988-08-23 US disclosed
US-4372582-A 2,2'-METHYLENEBIS(4-METHYL-6-T-BUTYL PHENOL) AS A STABILIZING AGENT MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1983-02-08 US disclosed
EP-0062467-A2 Stabilizer for electron donor-acceptor carbonless copying systems MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1982-10-13 EP disclosed