SCHEMBL8662792

SCHEMBL8662792

C1=Cc2c(c3c(c4ccccc24)CCCC3)CC1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PARP1 P09874 1/20 0.36
▸ BCHE P06276 4/20 0.31
▸ ACHE P22303 4/20 0.31
▸ ALDH1A1 P00352 3/20 0.31
▸ KDM4E B2RXH2 2/20 0.31
▸ TSHR P16473 2/20 0.31
▸ HSD17B10 Q99714 2/20 0.31
▸ CACNB4 O00305 1/20 0.31
▸ CACNA1A O00555 1/20 0.31
▸ SLC22A2 O15244 1/20 0.31
▸ SLC22A1 O15245 1/20 0.31
▸ ABCC4 O15439 1/20 0.31
▸ CACNA1G O43497 1/20 0.31
▸ CACNG3 O60359 1/20 0.31
▸ CACNA1F O60840 1/20 0.31
▸ CACNA1H O95180 1/20 0.31
▸ APP P05067 1/20 0.31
▸ CYP1A2 P05177 1/20 0.31
▸ FABP1 P07148 1/20 0.31
▸ CHRM2 P08172 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
SCHEMBL31488668 0.84 — —
SCHEMBL3419708 0.84 — —
SCHEMBL9459220 0.82 — —
SCHEMBL8663158 0.82 — —
SCHEMBL8661416 0.77 PARP1 (0.50) PARP1BCHEACHEALDH1A1KDM4E
SCHEMBL30455704 0.74 — —
SCHEMBL28355964 0.74 — —
SCHEMBL8662857 0.72 PARP1 (0.50) PARP1BCHEACHEALDH1A1KDM4E
SCHEMBL5829699 0.71 ALDH1A1 (0.33) ACHEALDH1A1HSD17B10CYP1A2ADORA3
SCHEMBL22654590 0.71 ALDH1A1 (0.36) ACHEALDH1A1HSD17B10CYP1A2ADORA3

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-5808154-A Process for the production of an aromatic hydrazo compound TOYO INK MANUFACTURING CO., LTD. (JP) 1998-09-15 — — US disclosed
EP-0391606-B1 Process for the production of an aromatic hydrazo compound TOYO INK MFG CO (JP) 1995-07-05 — — EP disclosed
EP-0391606-A1 Process for the production of an aromatic hydrazo compound TOYO INK MANUFACTURING CO., LTD. (JP) 1990-10-10 — — EP disclosed
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