SCHEMBL30719048

SCHEMBL30719048

Cc1cc(C(C)(C)C)ccc1Nc1ccc(C(C)(C)C)cc1C

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CSNK1D P48730 1/20 0.47
▸ TSHR P16473 1/20 0.44
▸ RAPGEF4 Q8WZA2 1/20 0.43
▸ ALDH1A1 P00352 2/20 0.43
▸ HPGD P15428 1/20 0.43
▸ ALOX15 P16050 1/20 0.43
▸ HSD17B10 Q99714 1/20 0.43
▸ TDP1 Q9NUW8 1/20 0.43
▸ NR1H4 Q96RI1 1/20 0.41
▸ VDR P11473 3/20 0.40
▸ AR P10275 1/20 0.40
▸ POLB P06746 1/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ GAA P10253 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ PKM P14618 1/20 0.39
▸ RECQL P46063 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ KDM4E B2RXH2 1/20 0.38
▸ FGFR2 P21802 1/20 0.37

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
SCHEMBL23927543 1.00 CSNK1D (0.47) CSNK1DTSHRRAPGEF4ALDH1A1HPGD
SCHEMBL28194326 0.87 AKR1C3 (0.49) CSNK1DTSHRRAPGEF4ALDH1A1HPGD
SCHEMBL19087556 0.85 RAPGEF4 (0.50) CSNK1DTSHRRAPGEF4ALDH1A1MEN1
SCHEMBL12320144 0.85 CSNK1D (0.39) CSNK1DRAPGEF4ALDH1A1ALOX15HSD17B10
SCHEMBL28173882 0.84 RAPGEF4 (0.44) CSNK1DTSHRRAPGEF4ALDH1A1HPGD
SCHEMBL29293656 0.84 CSNK1D (0.39) CSNK1DTSHRRAPGEF4ALDH1A1HPGD
SCHEMBL12320134 0.84 GAA (0.45) CSNK1DALDH1A1TDP1NR1H4MEN1
SCHEMBL13503241 0.82 TSHR (0.41) CSNK1DTSHRRAPGEF4ALDH1A1HPGD
SCHEMBL24255017 0.81 TAS2R14 (0.41) CSNK1DTSHRRAPGEF4ALDH1A1HPGD
SCHEMBL21004330 0.81 HTT (0.51) CSNK1DALDH1A1MEN1MAPTKMT2A

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
CN-113544136-B Compound and organic light emitting device comprising the same 株式会社LG化学 2024-04-05 — — CN disclosed
CN-113396151-B Polycyclic compound and organic light-emitting element including the same 株式会社LG化学 2024-04-05 — — CN disclosed
CN-113906581-B Organic light-emitting element 株式会社LG化学 2024-01-23 — — CN disclosed
Send feedback