Pyrogallol

Pyrogallol

SCHEMBL8879659

C=CCC(=O)CC=C.Oc1cccc(O)c1O

nearest known ligand 0.50

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CDK2 P24941 2/20 0.50
▸ CA1 P00915 2/20 0.50
▸ CA2 P00918 2/20 0.50
▸ ADAMTS4 O75173 1/20 0.50
▸ ALDH1A1 P00352 1/20 0.50
▸ EGFR P00533 1/20 0.50
▸ LMNA P02545 1/20 0.50
▸ FYN P06241 1/20 0.50
▸ MMP2 P08253 1/20 0.50
▸ MMP9 P14780 1/20 0.50
▸ HPGD P15428 1/20 0.50
▸ ALOX15 P16050 1/20 0.50
▸ MMP8 P22894 1/20 0.50
▸ CA6 P23280 1/20 0.50
▸ MMP12 P39900 1/20 0.50
▸ RECQL P46063 1/20 0.50
▸ HSD17B10 Q99714 1/20 0.50
▸ TDP1 Q9NUW8 1/20 0.50
▸ ADAMTS5 Q9UNA0 1/20 0.50
▸ ERN1 O75460 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
Pyrogallol SCHEMBL17183805 0.86 CA1 (0.48) CDK2CA1CA2ADAMTS4ALDH1A1
SCHEMBL6430271 0.79 TERT (0.46) CDK2CA1CA2ADAMTS4ALDH1A1
Phenol SCHEMBL3261952 0.77 CA12 (0.48) CA1CA2ALDH1A1LMNAHPGD
Pyrogallol SCHEMBL8879662 0.77 CA1 (0.52) CDK2CA1CA2ADAMTS4ALDH1A1
Benzene SCHEMBL6429767 0.77 LMNA (0.37) ALDH1A1LMNAHPGDALOX15HSD17B10
SCHEMBL17183803 0.76 PRKCA (0.43) CDK2CA1CA2ADAMTS4ALDH1A1
Pyrogallol SCHEMBL8070517 0.76 CA1 (0.57) CDK2CA1CA2ADAMTS4ALDH1A1
SCHEMBL6922195 0.75 AKR1B1 (0.57) CA2TDP1CA12CA9
Benzene SCHEMBL15863437 0.74 ALDH1A1 (0.35) ALDH1A1LMNAHPGDALOX15
Pyrogallol SCHEMBL28249612 0.74 ALDH1A1 (0.71) CDK2CA1CA2ADAMTS4ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0193166-B1 LIGHT-SENSITIVE COMPOSITION AND LIGHT-SENSITIVE POSITIVE REGISTRATION MATERIAL HOECHST CELANESE CORPORATION (US) 1991-05-08 — — EP claimed
US-5618932-A Photoactive compounds and compositions SHIPLEY COMPANY, L.L.C. (US) 1997-04-08 — — US disclosed
US-5514515-A Photoactive compounds having a heterocyclic group used in photoresist compositions SHIPLEY COMPANY, L.L.C. (US) 1996-05-07 — — US disclosed
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