SCHEMBL7982172

SCHEMBL7982172

CCCc1ccccc1Nc1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.47
GAA P10253 4/20 0.47
TDP1 Q9NUW8 3/20 0.47
KDM4E B2RXH2 2/20 0.47
MEN1 O00255 2/20 0.47
KMT2A Q03164 2/20 0.47
GLA P06280 1/20 0.47
RECQL P46063 1/20 0.47
ALDH1A1 P00352 5/20 0.45
LMNA P02545 1/20 0.45
CYP1A2 P05177 1/20 0.45
CYP2D6 P10635 1/20 0.45
CYP2C9 P11712 1/20 0.45
CYP2C19 P33261 1/20 0.45
HSD17B10 Q99714 3/20 0.42
ALOX15 P16050 3/20 0.42
HPGD P15428 3/20 0.42
TSHR P16473 2/20 0.42
TP53 P04637 1/20 0.42
CYP3A4 P08684 1/20 0.42

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
SCHEMBL2539193 0.89 MAPT (0.44) MAPTGAATDP1KDM4EMEN1
SCHEMBL3142020 0.89 ADRA2B (0.40) MAPTGAATDP1KDM4EMEN1
SCHEMBL13813554 0.87 ADRA2B (0.46) MAPTGAAKDM4EMEN1KMT2A
SCHEMBL9754655 0.87 KCNH3 (0.49) MAPTGAATDP1KDM4EMEN1
SCHEMBL31548023 0.85 LIPG (0.50) MAPTGAATDP1KDM4EMEN1
SCHEMBL11213224 0.85 LIPG (0.50) MAPTGAATDP1KDM4EMEN1
SCHEMBL28170208 0.85 MAPT (0.55) MAPTGAATDP1KDM4EMEN1
SCHEMBL11609802 0.85 LIPG (0.50) MAPTGAATDP1KDM4EMEN1
SCHEMBL2493912 0.85 LIPG (0.50) MAPTGAATDP1KDM4EMEN1
SCHEMBL29657744 0.83 MAPT (0.50) MAPTGAATDP1KDM4EMEN1

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-110240565-A A kind of preparation method of 9,9-dimethylacridan 郑州原理生物科技有限公司 2019-09-17 CN claimed
CN-110240565-A A kind of preparation method of 9,9-dimethylacridan 郑州原理生物科技有限公司 2019-09-17 CN disclosed
US-6235730-B1 ANTICHOLESTEROL AGENT, ANTILIPEMIC AGENT JAPAN TOBACCO, INC. (JP) 2001-05-22 US disclosed
EP-0970954-A1 3-PIPERIDYL-4-OXOQUINAZOLINE DERIVATIVES AND MEDICINCAL COMPOSITIONS CONTAINING THE SAME JAPAN TOBACCO INC. (JP) 2000-01-12 EP disclosed
US-4362893-A Preparation of C-nitrosodiarylamines from diarylamines UOP INC. (US) 1982-12-07 US disclosed