SCHEMBL8750128

SCHEMBL8750128

Cc1cc(C)c2oc(=O)ccc2c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 7/20 0.53
▸ GAA P10253 3/20 0.47
▸ MGAM O43451 1/20 0.47
▸ SI P14410 1/20 0.47
▸ MGAM2 Q2M2H8 1/20 0.47
▸ CA9 Q16790 7/20 0.46
▸ KDM4E B2RXH2 7/20 0.46
▸ HSD17B10 Q99714 6/20 0.46
▸ HPGD P15428 5/20 0.46
▸ CA12 O43570 5/20 0.46
▸ CA1 P00915 4/20 0.46
▸ CA7 P43166 4/20 0.46
▸ CA13 Q8N1Q1 4/20 0.46
▸ MAPT P10636 5/20 0.46
▸ MCL1 Q07820 4/20 0.46
▸ SMN1; SMN2 Q16637 4/20 0.46
▸ CYP3A4 P08684 4/20 0.46
▸ LMNA P02545 4/20 0.46
▸ ALOX15 P16050 3/20 0.46
▸ CYP1A2 P05177 3/20 0.46

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
SCHEMBL16283616 0.82 GAA (0.55) ALDH1A1GAAMGAMSIMGAM2
SCHEMBL14199261 0.81 MAOB (0.53) ALDH1A1GAAMGAMSIMGAM2
SCHEMBL9206553 0.81 ALDH1A1 (0.50) ALDH1A1GAAMGAMSIMGAM2
SCHEMBL11942254 0.81 GAA (0.44) ALDH1A1GAAMGAMSIMGAM2
Hydrochloric Acid SCHEMBL9229530 0.79 ALDH1A1 (0.49) ALDH1A1GAAMGAMSIMGAM2
SCHEMBL8750169 0.79 CA12 (0.49) ALDH1A1GAAMGAMSIMGAM2
SCHEMBL29902441 0.78 ALDH1A1 (0.47) ALDH1A1GAAMGAMSIMGAM2
SCHEMBL3136321 0.78 ALDH1A1 (0.47) ALDH1A1GAAMGAMSIMGAM2
SCHEMBL9981201 0.78 CYP2A6 (0.56) ALDH1A1GAAMGAMSIMGAM2
SCHEMBL8750123 0.78 CA12 (0.47) ALDH1A1GAAMGAMSIMGAM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5639893-A Process for producing octahydrocoumarins and same as a product of such process SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1997-06-17 — — US claimed
EP-0757989-A1 A process for producing octahydrocoumarins and same as a product of such process SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1997-02-12 — — EP claimed
EP-3597673-B1 PHOTOCROSSLINKABLE POLYMER, INSULATING FILM, PLANARIZATION FILM, LYOPHILIC/LIQUID REPELLENT PATTERNED FILM, AND ORGANIC FIELD EFFECT TRANSISTOR DEVICE COMPRISING SAME TOSOH CORP (JP) 2023-06-07 — — EP disclosed
US-20210135115-A1 PHOTOCROSSLINKABLE POLYMER, INSULATING FILM, PLANARIZATION FILM, LYOPHILIC/LIQUID REPELLENT PATTERNED FILM, AND ORGANIC FIELD EFFECT TRANSISTOR DEVICE COMPRISING SAME TOSOH CORPORATION (JP) 2021-05-06 — — US disclosed
US-5639893-A Process for producing octahydrocoumarins and same as a product of such process SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1997-06-17 — — US disclosed
EP-0757989-A1 A process for producing octahydrocoumarins and same as a product of such process SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1997-02-12 — — EP disclosed
US-4441969-A ARYL HYDROXY CARBOXYLIC ACID OMI INTERNATIONAL CORPORATION (US) 1984-04-10 — — US disclosed
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