SCHEMBL17422116

SCHEMBL17422116

Nc1cccc2c1ccn2C1CCNCC1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HTR6 P50406 8/20 0.43
▸ PRKCG P05129 2/20 0.39
▸ PRKCB P05771 1/20 0.39
▸ PRKCA P17252 1/20 0.39
▸ PRKCH P24723 1/20 0.39
▸ PRKCE Q02156 1/20 0.39
▸ PRKCZ Q05513 1/20 0.39
▸ PRKCD Q05655 1/20 0.39
▸ CAMK2B Q13554 1/20 0.39
▸ CAMK2G Q13555 1/20 0.39
▸ CAMK2D Q13557 1/20 0.39
▸ CAMK2A Q9UQM7 1/20 0.39
▸ ALDH1A1 P00352 2/20 0.37
▸ TDP1 Q9NUW8 2/20 0.37
▸ MEN1 O00255 1/20 0.37
▸ MAPT P10636 1/20 0.37
▸ PKM P14618 1/20 0.37
▸ ALOX15 P16050 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ DDB1 Q16531 2/20 0.36

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
SCHEMBL15910593 0.89 ALDH1A1 (0.38) ALDH1A1TDP1MEN1MAPTKMT2A
SCHEMBL15910562 0.85 MEN1 (0.38) ALDH1A1TDP1MEN1KMT2ADDB1
SCHEMBL8583731 0.81 HTR6 (0.43) HTR6PRKCGPRKCBPRKCAPRKCH
SCHEMBL25939067 0.80 DRD2 (0.43) HTR6PRKCGPRKCBPRKCAPRKCH
SCHEMBL15910903 0.78 LOXL2 (0.47) ALDH1A1TDP1MEN1MAPTKMT2A
SCHEMBL15910760 0.76 LOXL2 (0.39) DDB1CRBNHTR3ALCKKDR
SCHEMBL15910759 0.76 LOXL2 (0.39) DDB1CRBNHTR3ALCKKDR
SCHEMBL30098886 0.76 OPRL1 (0.40) ALDH1A1HPGD
SCHEMBL1239171 0.73 DRD2 (0.55) HTR6PRKCGPRKCBPRKCAPRKCH
SCHEMBL30588460 0.73 DRD2 (0.55) HTR6PRKCGPRKCBPRKCAPRKCH

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
EP-3166924-A1 AROMATIC HETEROCYCLIC DERIVATIVES AND PHARMACEUTICAL APPLICATIONS THEREOF Sunshine Lake Pharma Co., Ltd. (CN) 2017-05-17 — — EP disclosed
WO-2016004882-A1 AROMATIC HETEROCYCLIC DERIVATIVES AND PHARMACEUTICAL APPLICATIONS THEREOF SUNSHINE LAKE PHARMA CO., LTD. (CN) 2016-01-14 — — WO disclosed
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