SCHEMBL11842389

SCHEMBL11842389

O=C(c1ccccc1Cl)c1cc(Cl)ccc1Cl

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RECQL P46063 1/20 0.77
GABRP O00591 1/20 0.59
GABRD O14764 1/20 0.59
GABRA1 P14867 1/20 0.59
GABRB1 P18505 1/20 0.59
GABRG2 P18507 1/20 0.59
GABRB3 P28472 1/20 0.59
GABRA5 P31644 1/20 0.59
GABRA3 P34903 1/20 0.59
GABRA2 P47869 1/20 0.59
GABRB2 P47870 1/20 0.59
GABRA4 P48169 1/20 0.59
GABRE P78334 1/20 0.59
GABRA6 Q16445 1/20 0.59
GABRG1 Q8N1C3 1/20 0.59
GABRG3 Q99928 1/20 0.59
GABRQ Q9UN88 1/20 0.59
ALDH1A1 P00352 4/20 0.59
TP53 P04637 1/20 0.59
CES2 O00748 1/20 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
SCHEMBL9851141 0.90 RECQL (0.74) RECQLGABRPGABRDGABRA1GABRB1
SCHEMBL8160214 0.89 ALDH1A1 (0.71) RECQLGABRPGABRDGABRA1GABRB1
SCHEMBL5080596 0.88 RECQL (0.71) RECQLGABRPGABRDGABRA1GABRB1
SCHEMBL29829303 0.88 RECQL (0.71) RECQLGABRPGABRDGABRA1GABRB1
SCHEMBL13401358 0.87 ALDH1A1 (0.69) RECQLGABRPGABRDGABRA1GABRB1
SCHEMBL145258 0.87 RECQL (0.70) RECQLGABRPGABRDGABRA1GABRB1
SCHEMBL333313 0.87 RECQL (1.00) RECQLGABRPGABRDGABRA1GABRB1
SCHEMBL29516764 0.87 RECQL (1.00) RECQLGABRPGABRDGABRA1GABRB1
SCHEMBL8197244 0.85 RECQL (0.68) RECQLGABRPGABRDGABRA1GABRB1
SCHEMBL6940121 0.85 RECQL (0.58) RECQLGABRPGABRDGABRA1GABRB1

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
US-3956324-A THERMOPLASTIC POLYMER CIBA-GEIGY CORPORATION (US) 1976-05-11 US disclosed