SCHEMBL11178308

SCHEMBL11178308

Cc1cc(-c2cccc(N)c2)c(C)cn1

nearest known ligand 0.54

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ MAP4K4 O95819 7/20 0.54
▸ MEN1 O00255 1/20 0.43
▸ PSIP1 O75475 1/20 0.43
▸ AXL P30530 1/20 0.43
▸ MKNK1 Q9BUB5 1/20 0.43
▸ MKNK2 Q9HBH9 1/20 0.43
▸ KIT P10721 1/20 0.43
▸ FYN P06241 1/20 0.43
▸ MAOA P21397 1/20 0.42
▸ NPC1 O15118 2/20 0.41
▸ RAB9A P51151 2/20 0.41
▸ TSHR P16473 1/20 0.41
▸ RECQL P46063 1/20 0.41
▸ UHRF1 Q96T88 1/20 0.41
▸ USP7 Q93009 1/20 0.41
▸ METAP2 P50579 1/20 0.40
▸ ENPP2 Q13822 1/20 0.40

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
SCHEMBL11622916 0.81 USP7 (0.46) MAP4K4MEN1PSIP1AXLMKNK1
SCHEMBL30522572 0.80 UHRF1 (0.45) MAP4K4MEN1FYNNPC1RAB9A
SCHEMBL11254473 0.80 UHRF1 (0.45) MAP4K4MEN1FYNNPC1RAB9A
SCHEMBL12305117 0.80 CYP2A6 (0.47) MEN1NPC1RAB9ATSHRUHRF1
SCHEMBL11375205 0.79 HSD17B1 (0.50) FYN
SCHEMBL14287994 0.79 MAOA (0.54) MAP4K4MEN1PSIP1AXLMKNK1
SCHEMBL11185053 0.76 MEN1 (0.56) MAP4K4MEN1PSIP1AXLMKNK1
SCHEMBL9677424 0.76 PLA2G7 (0.52) MAP4K4MAOATSHRRECQL
SCHEMBL25756400 0.76 FGFR1 (0.44) MAP4K4UHRF1
SCHEMBL21982143 0.76 L3MBTL1 (0.46) MAP4K4MEN1FYNNPC1RAB9A

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4377585-A Use of 4-[4(or 3)-aminophenyl]pyridines as cardiotonic agents STERLING DRUG INC. (US) 1983-03-22 — — US disclosed
US-4376775-A N-[4-(4-Pyridinyl)phenyl]ureas and their cardiotonic use STERLING DRUG INC. (US) 1983-03-15 — — US disclosed
US-4317827-A 4-[4(or 3)-Acylaminophenyl]pyridines and their use as cardiotonics STERLING DRUG INC. (US) 1982-03-02 — — US disclosed
US-4297363-A 2-Amino-3(4 or 5)-(pyridinyl)phenols and their use as cardiotonics STERLING DRUG INC. (US) 1981-10-27 — — US disclosed
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