SCHEMBL23061562

SCHEMBL23061562

CC1(C)Nc2ccc(Br)cc2N1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TGM2 P21980 1/20 0.39
▸ CES1 P23141 1/20 0.39
▸ HTR2B P41595 1/20 0.39
▸ SIGMAR1 Q99720 1/20 0.39
▸ RAD52 P43351 1/20 0.39
▸ CMA1 P23946 1/20 0.38
▸ AHR P35869 1/20 0.38
▸ BRD4 O60885 1/20 0.38
▸ AKR1B1 P15121 1/20 0.36
▸ LMNA P02545 1/20 0.36
▸ PGR P06401 5/20 0.36
▸ PDPK1 O15530 2/20 0.35
▸ JAK2 O60674 2/20 0.35
▸ CA12 O43570 1/20 0.35
▸ CA1 P00915 1/20 0.35
▸ CA2 P00918 1/20 0.35
▸ CA4 P22748 1/20 0.35
▸ CA7 P43166 1/20 0.35
▸ CA9 Q16790 1/20 0.35
▸ SNCA P37840 1/20 0.35

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
SCHEMBL11752591 0.74 ALDH1A1 (0.47) RAD52AKR1B1CA12CA1CA2
SCHEMBL8111364 0.73 RAD52 (0.39) TGM2RAD52AKR1B1PGRCA12
SCHEMBL15621888 0.73 RAD52 (0.43) RAD52CA9MEN1KMT2AGAA
SCHEMBL11386072 0.73 CHEK1 (0.55) TGM2CES1HTR2BRAD52CMA1
SCHEMBL31344378 0.72 TGM2 (0.46) TGM2CES1CMA1AHRBRD4
SCHEMBL31223925 0.72 TGM2 (0.46) TGM2CES1CMA1AHRBRD4
SCHEMBL3642313 0.69 RAD52 (0.61) RAD52SNCAMEN1KMT2AGAA
SCHEMBL31394401 0.68 BRD4 (0.46) TGM2CES1CMA1AHRBRD4
SCHEMBL5031665 0.68 ALDH1A1 (0.38) RAD52
SCHEMBL14920957 0.68 CMA1 (0.42) TGM2CES1HTR2BSIGMAR1CMA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2022187403-A1 THYROID HORMONE RECEPTOR BETA AGONIST COMPOUNDS TERNS PHARMACEUTICALS, INC. (US) 2022-09-09 — — WO disclosed
WO-2021041237-A1 THYROID HORMONE RECEPTOR BETA AGONIST COMPOUNDS Terns, Inc. (US) 2021-03-04 — — WO disclosed
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