SCHEMBL10768681

SCHEMBL10768681

CCc1c(OC)c(OC)cc2[nH][c]nc12

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PTGS2 P35354 1/20 0.40
▸ ALOX5 P09917 3/20 0.33
▸ TUBB1 Q9H4B7 2/20 0.33
▸ TUBB4A P04350 1/20 0.33
▸ TUBB P07437 1/20 0.33
▸ TUBA3C P0DPH7 1/20 0.33
▸ TUBA1B P68363 1/20 0.33
▸ TUBA4A P68366 1/20 0.33
▸ TUBB4B P68371 1/20 0.33
▸ TUBB3 Q13509 1/20 0.33
▸ TUBB2A Q13885 1/20 0.33
▸ TUBB8 Q3ZCM7 1/20 0.33
▸ TUBA3E Q6PEY2 1/20 0.33
▸ TUBA1A Q71U36 1/20 0.33
▸ TUBA1C Q9BQE3 1/20 0.33
▸ TUBB6 Q9BUF5 1/20 0.33
▸ TUBB2B Q9BVA1 1/20 0.33
▸ KDM4E B2RXH2 3/20 0.32
▸ ALDH1A1 P00352 2/20 0.32
▸ SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL11602680 0.78 AMY1A (0.35) PTGS2TUBB1TUBB4ATUBBTUBA3C
SCHEMBL10833235 0.69 KDM4E (0.36) KDM4EALDH1A1SMN1; SMN2CYP3A4MAPT
SCHEMBL15156699 0.66 GRIN2D (0.41) KDM4EALDH1A1SMN1; SMN2LMNAPOLB
SCHEMBL18894149 0.66 GRIN2D (0.32) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL18894158 0.65 SIRT1 (0.31) —
SCHEMBL11808824 0.64 PTGS2 (0.52) PTGS2ALOX5TUBB1KDM4EALDH1A1
SCHEMBL8562960 0.64 TUBB4A (0.37) TUBB1TUBB4ATUBBTUBA3CTUBA1B
SCHEMBL557929 0.64 KEAP1 (0.44) ALDH1A1SMN1; SMN2CYP3A4MAPTHSD17B10
SCHEMBL6883568 0.62 CCNB2 (0.34) KDM4EMAPTACHEPOLB
SCHEMBL15569439 0.62 BRD4 (0.42) PTGS2TUBB1TUBB4ATUBBTUBA3C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0240015-A2 Carbostyril derivatives, process for preparing them, pharmaceutical composition, and use OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1987-10-07 — — EP disclosed
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