SCHEMBL25058962

SCHEMBL25058962

Cc1ccc2c3ccc(C(C)(C)C)cc3n(N)c2c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TSHR P16473 1/20 0.43
▸ CCR9 P51686 1/20 0.36
▸ HTR1D P28221 1/20 0.36
▸ POLB P06746 1/20 0.35
▸ ALDH1A1 P00352 2/20 0.35
▸ MAPT P10636 2/20 0.35
▸ MEN1 O00255 1/20 0.35
▸ GAA P10253 1/20 0.35
▸ PKM P14618 1/20 0.35
▸ RECQL P46063 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ KIF11 P52732 5/20 0.35
▸ HPGD P15428 1/20 0.34
▸ ALOX15 P16050 1/20 0.34
▸ HSD17B10 Q99714 1/20 0.34
▸ TDP1 Q9NUW8 1/20 0.34
▸ BCL2 P10415 1/20 0.34
▸ MDM2 Q00987 1/20 0.34
▸ MCL1 Q07820 1/20 0.34
▸ HRH4 Q9H3N8 2/20 0.33

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
SCHEMBL25058934 0.93 TSHR (0.41) TSHRCCR9HTR1DPOLBALDH1A1
SCHEMBL25058960 0.93 TSHR (0.41) TSHRCCR9HTR1DPOLBALDH1A1
SCHEMBL25058952 0.91 ALDH1A1 (0.41) TSHRHTR1DALDH1A1MAPTMEN1
SCHEMBL25058946 0.85 HTR1D (0.44) TSHRHTR1DALDH1A1MAPTMEN1
SCHEMBL19820294 0.84 ALDH1A1 (0.39) ALDH1A1MAPTMEN1GAAKMT2A
SCHEMBL20096916 0.84 KIF11 (0.49) TSHRCCR9HTR1DALDH1A1MAPT
SCHEMBL25058980 0.84 TSHR (0.45) TSHRCCR9HTR1DPOLBALDH1A1
SCHEMBL19373834 0.82 TSHR (0.43) TSHRCCR9HTR1DPOLBALDH1A1
SCHEMBL25058998 0.82 KIF11 (0.47) HTR1DALDH1A1MAPTMEN1GAA
SCHEMBL25058933 0.81 BCHE (0.38) ALDH1A1MAPTMEN1GAAPKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4137551-A1 ORGANIC ELECTROLUMINESCENT MATERIAL AND DEVICE THEREOF Beijing Summer Sprout Technology Co., Ltd. (CN) 2023-02-22 — — EP disclosed
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