SCHEMBL9036792

SCHEMBL9036792

NNc1ccc(O)c(O)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ARG1 P05089 1/20 0.48
APP P05067 1/20 0.43
TOP1 P11387 1/20 0.43
SNCA P37840 2/20 0.41
TDP1 Q9NUW8 3/20 0.41
KDM4E B2RXH2 2/20 0.41
MAPT P10636 2/20 0.41
NPC1 O15118 1/20 0.41
POLB P06746 1/20 0.41
RAB9A P51151 1/20 0.41
TRPA1 O75762 1/20 0.40
CA1 P00915 2/20 0.39
CA2 P00918 2/20 0.39
CA4 P22748 2/20 0.39
CA6 P23280 2/20 0.39
CA12 O43570 1/20 0.39
CA5A P35218 1/20 0.39
CA7 P43166 1/20 0.39
CA9 Q16790 1/20 0.39
CA14 Q9ULX7 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
SCHEMBL9505716 0.80 MAPT (0.38) ARG1TDP1KDM4EMAPTNPC1
SCHEMBL27870146 0.80 ALDH1A1 (0.48) TDP1KDM4EMAPTNPC1POLB
SCHEMBL27995684 0.78 PDE10A (0.52) TDP1KDM4EMAPTALOX15CYP2D6
SCHEMBL8083862 0.78 CA6 (0.50) TDP1KDM4EMAPTNPC1POLB
SCHEMBL14465086 0.78 TSHR (0.52) KDM4EMAPTNPC1RAB9ATRPA1
SCHEMBL11942144 0.78 CA2 (0.52) TDP1KDM4EMAPTNPC1POLB
SCHEMBL12285116 0.78 ARG1 (0.52) ARG1APPTOP1SNCATRPA1
Hydrochloric Acid SCHEMBL4206989 0.77 CA2 (0.50) TDP1KDM4EMAPTNPC1POLB
Hydrochloric Acid SCHEMBL16280191 0.77 TSHR (0.50) KDM4EMAPTNPC1RAB9ATRPA1
SCHEMBL11405325 0.76 ARG1 (0.50) ARG1APPTOP1SNCATRPA1

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
CN-113416315-B Hyperbranched poly-tertiary amine shale inhibitor 西南石油大学 2022-09-30 CN disclosed
CN-113416524-A High-temperature-resistant hyperbranched poly-tertiary amine as shale inhibitor 西南石油大学 2021-09-21 CN disclosed
EP-0566446-B1 Derivatives of indane-1,3-dione and indane-1,2,3-trione, processes for their preparation and their application in therapy INNOTHERA LAB SA (FR) 1996-02-07 EP disclosed
EP-0566446-A1 Derivatives of indane-1,3-dione and indane-1,2,3-trione, processes for their preparation and their application in therapy INNOTHERA (FR) 1993-10-20 EP disclosed
WO-1993020046-A1 INDAN-1,3-DIONE AND INDAN-1,2,3-TRIONE DERIVATIVES, PROCESSES FOR PREPARATION OF SAME AND THEIR USE AS THERAPEUTIC AGENTS INNOTHERA (FR) 1993-10-14 WO disclosed