SCHEMBL9768958

SCHEMBL9768958

NN=Cc1ncccc1O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.39
▸ L3MBTL1 Q9Y468 2/20 0.39
▸ MMP2 P08253 1/20 0.39
▸ CHRM1 P11229 1/20 0.39
▸ TSHR P16473 1/20 0.39
▸ COMT P21964 1/20 0.39
▸ ADRA1A P35348 1/20 0.39
▸ METAP2 P50579 1/20 0.39
▸ METAP1 P53582 1/20 0.39
▸ HDAC8 Q9BY41 1/20 0.39
▸ RRM2 P31350 3/20 0.39
▸ RRM1 P23921 1/20 0.39
▸ RRM2B Q7LG56 1/20 0.39
▸ CISD1 Q9NZ45 1/20 0.39
▸ HSD17B10 Q99714 2/20 0.38
▸ CYP1A2 P05177 1/20 0.38
▸ CYP3A4 P08684 1/20 0.38
▸ CYP2C9 P11712 1/20 0.38
▸ HIF1A Q16665 1/20 0.38
▸ PHLPP2 Q6ZVD8 1/20 0.38

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
SCHEMBL19668661 0.83 ALDH1A1 (0.42) ALDH1A1L3MBTL1MMP2CHRM1TSHR
SCHEMBL16712006 0.82 FGF23 (0.45) ALDH1A1L3MBTL1MMP2CHRM1TSHR
SCHEMBL29402625 0.82 FGF23 (0.45) ALDH1A1L3MBTL1MMP2CHRM1TSHR
SCHEMBL19003507 0.80 NPC1 (0.40) ALDH1A1L3MBTL1MMP2CHRM1TSHR
SCHEMBL25515518 0.76 NFE2L2 (0.49) —
SCHEMBL8599677 0.76 SRC (0.43) ALDH1A1L3MBTL1MMP2CHRM1TSHR
SCHEMBL6676551 0.74 RRM2 (0.73) L3MBTL1RRM2RRM1RRM2BCISD1
SCHEMBL6676547 0.74 RRM2 (0.73) L3MBTL1RRM2RRM1RRM2BCISD1
SCHEMBL9289701 0.74 RRM2 (0.52) L3MBTL1RRM2RRM1RRM2BCISD1
SCHEMBL9267384 0.74 RRM2 (0.52) L3MBTL1RRM2RRM1RRM2BCISD1

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
US-5011932-A Anthelmintic pyridinyl acylhydrazones derivatives UPJOHN COMPANY (US) 1991-04-30 — — US claimed
EP-0214158-A1 ANTHELMINTIC PYRIDINYL ACYLHYDRAZONES, METHOD OF USE AND COMPOSITIONS THE UPJOHN COMPANY (US) 1987-03-18 — — EP claimed
WO-1986004582-A1 ANTHELMINTIC PYRIDINYL ACYLHYDRAZONES, METHOD OF USE AND COMPOSITIONS THE UPJOHN COMPANY (US) 1986-08-14 — — WO claimed
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