SCHEMBL9735988

SCHEMBL9735988

Cc1ccc(-n2c(=O)c3c[nH]c4ccc(Cl)cc4n-3c2=O)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 4/20 0.39
DUSP3 P51452 1/20 0.39
PTPN5 P54829 1/20 0.39
PTPN11 Q06124 1/20 0.39
GABRP O00591 1/20 0.39
GABRD O14764 1/20 0.39
ADORA3 P0DMS8 1/20 0.39
GABRA1 P14867 1/20 0.39
GABRB1 P18505 1/20 0.39
GABRG2 P18507 1/20 0.39
GABRB3 P28472 1/20 0.39
ADORA1 P30542 1/20 0.39
GABRA5 P31644 1/20 0.39
GABRA3 P34903 1/20 0.39
GABRA2 P47869 1/20 0.39
GABRB2 P47870 1/20 0.39
GABRA4 P48169 1/20 0.39
GABRE P78334 1/20 0.39
GABRA6 Q16445 1/20 0.39
GABRG1 Q8N1C3 1/20 0.39

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
SCHEMBL7953519 0.90 LMNA (0.42) POLBDUSP3PTPN5PTPN11ALDH1A1
SCHEMBL7948011 0.82 TP53 (0.38) ADORA3GABRA1GABRG2GABRB3GABRA3
SCHEMBL7941792 0.82 SMN1; SMN2 (0.43) POLBADORA3ALDH1A1KDM4ESMN1; SMN2
SCHEMBL7951665 0.79 LMNA (0.40) ADORA3ADORA1ALDH1A1KDM4ESMN1; SMN2
SCHEMBL7949177 0.74 KDM4E (0.51) ALDH1A1KDM4ESMN1; SMN2RAB9ALMNA
SCHEMBL7949052 0.71 KMT2A (0.44) POLBALDH1A1KDM4ESMN1; SMN2MAPT
SCHEMBL7941798 0.70 PGR (0.46) KDM4ELMNAMAPK1MEN1KMT2A
SCHEMBL7949077 0.69 MAPT (0.42) POLBALDH1A1KDM4ESMN1; SMN2LMNA
SCHEMBL7949731 0.69 HSP90AA1 (0.41) POLBADORA3ADORA1ALDH1A1KDM4E
SCHEMBL7941785 0.69 LMNA (0.39) POLBADORA3SMN1; SMN2RAB9ALMNA

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
US-5130430-A Anxiety, sleep disorders or seizures NEUROGEN CORPORATION (US) 1992-07-14 US claimed
US-5130430-A Anxiety, sleep disorders or seizures NEUROGEN CORPORATION (US) 1992-07-14 US disclosed