SCHEMBL7916986

SCHEMBL7916986

COc1cccc(Cn2nc(C(=O)O)c3c2-c2ccc(OCc4cncnc4)cc2CC3)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 3/20 0.46
▸ GAA P10253 1/20 0.46
▸ PKM P14618 1/20 0.46
▸ LMNA P02545 3/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ NPSR1 Q6W5P4 1/20 0.42
▸ HSD17B10 Q99714 3/20 0.42
▸ TSHR P16473 2/20 0.42
▸ KDM4E B2RXH2 2/20 0.42
▸ PIK3CD O00329 1/20 0.41
▸ PIK3R2 O00459 1/20 0.41
▸ PIK3CA P42336 1/20 0.41
▸ PIK3CB P42338 1/20 0.41
▸ PIK3CG P48736 1/20 0.41
▸ PIK3R5 Q8WYR1 1/20 0.41
▸ PIK3R3 Q92569 1/20 0.41
▸ CCNA2 P20248 2/20 0.41
▸ CDK2 P24941 2/20 0.41
▸ CCNA1 P78396 2/20 0.41
▸ AURKA O14965 1/20 0.41

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
SCHEMBL7911558 0.94 ALDH1A1 (0.40) ALDH1A1GAAPKMLMNASMN1; SMN2
SCHEMBL7911574 0.93 LMNA (0.43) ALDH1A1GAAPKMLMNASMN1; SMN2
SCHEMBL7903219 0.91 LMNA (0.38) ALDH1A1GAAPKMLMNASMN1; SMN2
SCHEMBL7916990 0.91 LMNA (0.41) LMNASMN1; SMN2NPSR1HSD17B10TSHR
SCHEMBL7910595 0.91 L3MBTL1 (0.35) ALDH1A1GAAPKMLMNASMN1; SMN2
Hydrochloric Acid SCHEMBL7911590 0.89 ITGB3 (0.37) LMNASMN1; SMN2NPSR1HSD17B10TSHR
SCHEMBL7910597 0.88 ALDH1A1 (0.36) ALDH1A1GAAPKMLMNASMN1; SMN2
SCHEMBL7910547 0.87 HSD17B10 (0.38) ALDH1A1GAAPKMLMNASMN1; SMN2
SCHEMBL7911545 0.86 CCNA2 (0.38) ALDH1A1LMNASMN1; SMN2NPSR1HSD17B10
SCHEMBL7903245 0.86 SMN1; SMN2 (0.44) ALDH1A1LMNASMN1; SMN2NPSR1HSD17B10

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
JP-11029569-A — — None — — JP disclosed
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
JP-H1129569-A 4,5-DIHYDRO-(1H)-BENZ(G)INDAZOLE-3-CARBOXYLIC ACID DERIVATIVE TEIKOKU HORMONE MFG CO LTD 1999-02-02 — — JP disclosed
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