SCHEMBL7911579

SCHEMBL7911579

COC(=O)c1nn(Cc2ccccc2)c2c1CCc1cc(O)ccc1-2

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 4/20 0.46
▸ LMNA P02545 1/20 0.46
▸ NPSR1 Q6W5P4 1/20 0.46
▸ HCAR2 Q8TDS4 3/20 0.45
▸ CYP2C9 P11712 1/20 0.45
▸ CYP1A2 P05177 1/20 0.44
▸ MAPT P10636 5/20 0.41
▸ GAA P10253 2/20 0.41
▸ ALDH1A1 P00352 2/20 0.41
▸ CCNA2 P20248 1/20 0.41
▸ CDK2 P24941 1/20 0.41
▸ CCNA1 P78396 1/20 0.41
▸ PKM P14618 1/20 0.41
▸ HTT P42858 2/20 0.41
▸ TP53 P04637 4/20 0.40
▸ CNR2 P34972 1/20 0.40
▸ THRB P10828 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ HSD17B10 Q99714 1/20 0.39
▸ RAD52 P43351 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
SCHEMBL7913431 0.88 SMN1; SMN2 (0.47) SMN1; SMN2LMNANPSR1CYP1A2MAPT
SCHEMBL7903245 0.84 SMN1; SMN2 (0.44) SMN1; SMN2LMNANPSR1CYP1A2MAPT
SCHEMBL7903260 0.80 SMN1; SMN2 (0.39) SMN1; SMN2LMNANPSR1MAPTALDH1A1
SCHEMBL11863026 0.76 KMT2A (0.53) SMN1; SMN2NPSR1CYP2C9CYP1A2MAPT
SCHEMBL7911574 0.76 LMNA (0.43) SMN1; SMN2LMNANPSR1CYP2C9CYP1A2
SCHEMBL7910547 0.75 HSD17B10 (0.38) SMN1; SMN2LMNANPSR1MAPTGAA
SCHEMBL6791972 0.74 ALDH1A1 (0.53) NPSR1CYP2C9GAAALDH1A1CCNA2
SCHEMBL7911545 0.74 CCNA2 (0.38) SMN1; SMN2LMNANPSR1MAPTALDH1A1
SCHEMBL7916990 0.73 LMNA (0.41) SMN1; SMN2LMNANPSR1CCNA2CDK2
SCHEMBL14349873 0.72 SMN1; SMN2 (0.51) SMN1; SMN2LMNANPSR1HCAR2CYP2C9

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-6291485-B1 TREATMENT OF POST-PTCA RESTENOSIS TEIKOKU HORMONE MFG. CO., LTD. (JP) 2001-09-18 — — US disclosed
EP-1002797-A1 4,5-DIHYDRO- 1H]-BENZ g]INDAZOLE-3-CARBOXYLIC ACID DERIVATIVES TEIKOKU HORMONE MFG. CO., LTD. (JP) 2000-05-24 — — EP disclosed
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