SCHEMBL9614598

SCHEMBL9614598

C[CH]CC(Nc1ccccc1)Nc1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TDP1 Q9NUW8 4/20 0.48
▸ ALDH1A1 P00352 6/20 0.42
▸ TSHR P16473 4/20 0.42
▸ HSD17B10 Q99714 4/20 0.42
▸ ALOX15 P16050 3/20 0.42
▸ ALOX12 P18054 3/20 0.42
▸ CYP3A4 P08684 2/20 0.42
▸ L3MBTL1 Q9Y468 2/20 0.42
▸ LMNA P02545 1/20 0.42
▸ THRB P10828 1/20 0.42
▸ RECQL P46063 1/20 0.42
▸ ATM Q13315 1/20 0.42
▸ MAPK1 P28482 2/20 0.40
▸ HIF1A Q16665 1/20 0.40
▸ GAA P10253 1/20 0.37
▸ CA12 O43570 1/20 0.36
▸ CA9 Q16790 1/20 0.36
▸ CTSD P07339 1/20 0.35
▸ KDM4E B2RXH2 1/20 0.34
▸ KCNH3 Q9ULD8 1/20 0.33

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
SCHEMBL1454124 0.81 TDP1 (0.52) TDP1ALDH1A1TSHRHSD17B10ALOX15
SCHEMBL2729293 0.78 TDP1 (0.43) TDP1ALDH1A1TSHRHSD17B10ALOX15
SCHEMBL1455075 0.78 TDP1 (0.43) TDP1ALDH1A1TSHRHSD17B10ALOX15
SCHEMBL1454866 0.75 TDP1 (0.41) TDP1ALDH1A1TSHRHSD17B10ALOX15
SCHEMBL4457363 0.75 TDP1 (0.61) TDP1ALDH1A1TSHRHSD17B10ALOX15
SCHEMBL1453954 0.72 ENPP2 (0.40) TDP1ALDH1A1TSHRHSD17B10ALOX15
SCHEMBL10767986 0.70 TDP1 (0.48) TDP1ALDH1A1TSHRHSD17B10ALOX15
SCHEMBL7708792 0.70 TDP1 (0.48) TDP1ALDH1A1TSHRHSD17B10ALOX15
SCHEMBL9572775 0.69 MAPT (0.43) TDP1ALDH1A1TSHRHSD17B10ALOX15
SCHEMBL1455460 0.69 CYP3A4 (0.49) TDP1ALDH1A1TSHRHSD17B10ALOX15

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0479943-A4 ADHESIVES AND METHOD FOR MAKING SAME — 1992-09-16 — — EP disclosed
EP-0479943-A1 ADHESIVES AND METHOD FOR MAKING SAME MARTIN MARIETTA ENERGY SYSTEMS, INC. (US) 1992-04-15 — — EP disclosed
WO-1991000308-A1 ADHESIVES AND METHOD FOR MAKING SAME MARTIN MARIETTA ENERGY SYSTEMS, INC. (US) 1991-01-10 — — WO disclosed
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