SCHEMBL10481998

SCHEMBL10481998

N#Cc1ccc(N2CCc3nc4ccccc4c(Cl)c3C2)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.40
▸ KMT2A Q03164 2/20 0.40
▸ MAPT P10636 1/20 0.39
▸ POLB P06746 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ NPSR1 Q6W5P4 1/20 0.39
▸ ATM Q13315 2/20 0.39
▸ HTT P42858 1/20 0.39
▸ L3MBTL1 Q9Y468 1/20 0.39
▸ CYP1A2 P05177 2/20 0.38
▸ CYP2D6 P10635 2/20 0.38
▸ THRB P10828 1/20 0.38
▸ BCHE P06276 2/20 0.36
▸ ACHE P22303 2/20 0.36
▸ KDM4E B2RXH2 2/20 0.36
▸ CACNB4 O00305 1/20 0.36
▸ CACNA1A O00555 1/20 0.36
▸ SLC22A2 O15244 1/20 0.36
▸ SLC22A1 O15245 1/20 0.36
▸ ABCC4 O15439 1/20 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
SCHEMBL10481983 0.89 HRH4 (0.41) MAPTPOLBSMN1; SMN2L3MBTL1BCHE
SCHEMBL10481993 0.86 MAPT (0.45) MEN1KMT2AMAPTPOLBSMN1; SMN2
SCHEMBL10481974 0.84 ACHE (0.41) MEN1KMT2AMAPTPOLBSMN1; SMN2
SCHEMBL10482101 0.84 MAPT (0.46) MEN1KMT2AMAPTPOLBSMN1; SMN2
SCHEMBL10481927 0.76 ACHE (0.47) MAPTPOLBSMN1; SMN2NPSR1CYP1A2
SCHEMBL10481950 0.75 METAP1 (0.51) MEN1KMT2AMAPTPOLBSMN1; SMN2
SCHEMBL6919274 0.73 MEN1 (0.48) MEN1KMT2AMAPTCYP1A2CYP2D6
SCHEMBL10482089 0.73 MAPT (0.44) MAPTSMN1; SMN2BCHEACHEALDH1A1
SCHEMBL15131972 0.72 KMT2A (0.57) MEN1KMT2AMAPTNPSR1KDM4E
SCHEMBL10608330 0.72 GPR39 (0.41) KMT2ABCHEACHECHRM1

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-4808612-A ANTIINFLAMMATORY AGENTS AMERICAN HOME PRODUCTS CORPORATION (US) 1989-02-28 — — US claimed
US-4808612-A ANTIINFLAMMATORY AGENTS AMERICAN HOME PRODUCTS CORPORATION (US) 1989-02-28 — — US disclosed
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