SCHEMBL10688708

SCHEMBL10688708

Cc1ccc2c3c(ncc2c1)CCC(=O)N3

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 2/20 0.36
▸ SIRT1 Q96EB6 1/20 0.36
▸ PARP1 P09874 2/20 0.35
▸ CHEK1 O14757 1/20 0.35
▸ PIM1 P11309 1/20 0.35
▸ RPS6KA3 P51812 1/20 0.35
▸ TYMS P04818 1/20 0.33
▸ HSD17B10 Q99714 1/20 0.33
▸ DDB1 Q16531 1/20 0.32
▸ CRBN Q96SW2 1/20 0.32
▸ KDM4E B2RXH2 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ MAPT P10636 1/20 0.32
▸ EPHX2 P34913 1/20 0.32
▸ NUAK1 O60285 1/20 0.32
▸ P2RX4 Q99571 1/20 0.32
▸ PDE3B Q13370 1/20 0.32
▸ PDE3A Q14432 1/20 0.32
▸ IDO1 P14902 1/20 0.32
▸ ACHE P22303 1/20 0.31

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
SCHEMBL10686542 0.83 SRD5A1 (0.37) LMNAPARP1CHEK1TYMSDDB1
SCHEMBL10379371 0.83 SRD5A1 (0.37) LMNATYMSDDB1CRBNALDH1A1
SCHEMBL7594487 0.79 CYP11B1 (0.42) LMNAPARP1HSD17B10DDB1CRBN
SCHEMBL10689555 0.77 CYP1A2 (0.36) TYMSDDB1CRBN
SCHEMBL10687008 0.75 ACHE (0.38) HSD17B10ALDH1A1ACHE
SCHEMBL10685831 0.74 CYP19A1 (0.35) CHEK1PIM1TYMSDDB1CRBN
SCHEMBL10377999 0.74 SRD5A1 (0.40) PARP1CHEK1TYMSDDB1CRBN
SCHEMBL10689321 0.74 ABL1 (0.39) LMNATYMSHSD17B10KDM4EALDH1A1
SCHEMBL21827508 0.68 CYP19A1 (0.36) DDB1CRBN
SCHEMBL14494399 0.67 PDE3A (0.36) LMNADDB1CRBNKDM4EALDH1A1

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-4742061-A Benzoc[c]-1,5-naphthyridines and related compounds as memory enhancing agents HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) 1988-05-03 — — US claimed
US-4742061-A Benzoc[c]-1,5-naphthyridines and related compounds as memory enhancing agents HOECHST-ROUSSEL PHARMACEUTICALS INC. (US) 1988-05-03 — — US disclosed
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