SCHEMBL11966149

SCHEMBL11966149

CCN(CC)c1ccc2c(c1)C(C)(C)c1ccccc1-2

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PDK2 Q15119 6/20 0.44
▸ S100B P04271 1/20 0.42
▸ MEN1 O00255 4/20 0.41
▸ KMT2A Q03164 4/20 0.41
▸ ALDH1A1 P00352 4/20 0.41
▸ MAPT P10636 4/20 0.41
▸ L3MBTL1 Q9Y468 3/20 0.41
▸ MAPK1 P28482 2/20 0.41
▸ HPGD P15428 1/20 0.41
▸ HSD17B10 Q99714 1/20 0.41
▸ RAB9A P51151 2/20 0.41
▸ GAA P10253 2/20 0.41
▸ MLNR O43193 1/20 0.40
▸ NR1I2 O75469 1/20 0.40
▸ CHRM2 P08172 1/20 0.40
▸ ADRB1 P08588 1/20 0.40
▸ HTR1A P08908 1/20 0.40
▸ ADRA2A P08913 1/20 0.40
▸ CHRM1 P11229 1/20 0.40
▸ DRD2 P14416 1/20 0.40

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
SCHEMBL11966150 0.87 PDK2 (0.42) PDK2ALDH1A1HSD17B10GAAMLNR
SCHEMBL15468991 0.84 PDK2 (0.44) PDK2MEN1KMT2AALDH1A1MAPT
SCHEMBL14340096 0.84 PDK2 (0.44) PDK2MEN1KMT2AALDH1A1MAPT
SCHEMBL23658858 0.83 RXRA (0.40) PDK2MLNRNR1I2CHRM2ADRB1
SCHEMBL23343410 0.83 NR3C2 (0.43) PDK2MAPTMLNRNR1I2CHRM2
SCHEMBL29844536 0.82 PDK2 (0.45) PDK2MLNRNR1I2CHRM2ADRB1
SCHEMBL10029832 0.82 PDK2 (0.45) PDK2MLNRNR1I2CHRM2ADRB1
SCHEMBL1753506 0.82 PDK2 (0.45) PDK2MLNRNR1I2CHRM2ADRB1
SCHEMBL28635208 0.82 ALDH1A1 (0.52) PDK2S100BMEN1KMT2AALDH1A1
SCHEMBL16200615 0.81 PDK2 (0.46) PDK2MEN1KMT2AALDH1A1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8243113-B2 Ordinary-temperature-phosphorescent organic material, reversibly thermosensitive recording material, reversibly thermosensitive recording medium, and method of recording in reversibly thermosensitive recording medium NATIONAL UNIVERSITY CORPORATION TOKYO UNIVERSITY OF AGRICULTURE AND TECHNOLOGY (JP) 2012-08-14 — — US disclosed
US-8243113-B2 Ordinary-temperature-phosphorescent organic material, reversibly thermosensitive recording material, reversibly thermosensitive recording medium, and method of recording in reversibly thermosensitive recording medium NATIONAL UNIVERSITY CORPORATION TOKYO UNIVERSITY OF AGRICULTURE AND TECHNOLOGY (JP) 2012-08-14 — — US disclosed
US-20100328412-A1 ORDINARY-TEMPERATURE-PHOSPHORESCENT ORGANIC MATERIAL, REVERSIBLY THERMOSENSITIVE RECORDING MATERIAL, REVERSIBLY THERMOSENSITIVE RECORDING MEDIUM, AND METHOD OF RECORDING IN REVERSIBLY THERMOSENSITIVE RECORDING MEDIUM NATIONAL UNIVERSITY CORPORATION TOKYO UNIVERSITY OF AGRICULTURE AND TECHNOLOGY (JP) 2010-12-30 — — US disclosed
US-20100328412-A1 ORDINARY-TEMPERATURE-PHOSPHORESCENT ORGANIC MATERIAL, REVERSIBLY THERMOSENSITIVE RECORDING MATERIAL, REVERSIBLY THERMOSENSITIVE RECORDING MEDIUM, AND METHOD OF RECORDING IN REVERSIBLY THERMOSENSITIVE RECORDING MEDIUM NATIONAL UNIVERSITY CORPORATION TOKYO UNIVERSITY OF AGRICULTURE AND TECHNOLOGY (JP) 2010-12-30 — — US disclosed
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