SCHEMBL30480932

SCHEMBL30480932

N#Cc1ccc2[nH]c3ccccc3c2c1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHUK O15111 1/20 0.63
AR P10275 1/20 0.61
AHR P35869 1/20 0.57
GABRP O00591 1/20 0.57
GABRD O14764 1/20 0.57
GABRA1 P14867 1/20 0.57
GABRB1 P18505 1/20 0.57
GABRG2 P18507 1/20 0.57
GABRB3 P28472 1/20 0.57
GABRA5 P31644 1/20 0.57
GABRA3 P34903 1/20 0.57
GABRA2 P47869 1/20 0.57
GABRB2 P47870 1/20 0.57
GABRA4 P48169 1/20 0.57
GABRE P78334 1/20 0.57
GABRA6 Q16445 1/20 0.57
GABRG1 Q8N1C3 1/20 0.57
GABRG3 Q99928 1/20 0.57
GABRQ Q9UN88 1/20 0.57
ALDH1A1 P00352 2/20 0.54

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
SCHEMBL31272617 1.00 CHUK (0.63) CHUKARAHRGABRPGABRD
SCHEMBL31273378 1.00 CHUK (0.63) CHUKARAHRGABRPGABRD
SCHEMBL1247669 1.00 CHUK (0.63) CHUKARAHRGABRPGABRD
Hydrochloric Acid SCHEMBL27851102 0.98 CHUK (0.61) CHUKARAHRGABRPGABRD
SCHEMBL31139500 0.93 CHUK (0.56) CHUKARAHRGABRPGABRD
SCHEMBL29402283 0.90 CHUK (0.68) CHUKARMEN1KMT2AFASN
SCHEMBL606784 0.90 CHUK (0.68) CHUKARMEN1KMT2AFASN
SCHEMBL30545930 0.90 CHUK (0.68) CHUKARMEN1KMT2AFASN
SCHEMBL6009650 0.89 KIF11 (0.58) CHUKARAHRGABRPGABRD
SCHEMBL30414171 0.89 KIF11 (0.58) CHUKARAHRGABRPGABRD

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
CN-116583522-A Indolo [3.2.1-JK ] carbazole-6-carbonitrile derivatives as blue fluorescent emitters for use in OLEDs 默克专利有限公司 2023-08-11 CN disclosed