SCHEMBL7429602

SCHEMBL7429602

OC(CCC1CCCCC1)CCC1CCCCC1

nearest known ligand 0.50

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
METAP1 P53582 1/20 0.50
CYP1A2 P05177 1/20 0.42
SIGMAR1 Q99720 1/20 0.39
KDM4E B2RXH2 1/20 0.39
HPGD P15428 1/20 0.38
METAP2 P50579 1/20 0.36
TP53 P04637 1/20 0.36

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
SCHEMBL7441567 0.89 METAP1 (0.43) METAP1CYP1A2SIGMAR1METAP2
SCHEMBL4623479 0.89 CYP1A2 (0.50) METAP1CYP1A2SIGMAR1KDM4EMETAP2
SCHEMBL1111381 0.88 METAP1 (0.46) METAP1CYP1A2SIGMAR1KDM4EHPGD
SCHEMBL13169084 0.88 METAP1 (0.46) METAP1CYP1A2SIGMAR1KDM4EHPGD
SCHEMBL10763159 0.86 METAP1 (0.48) METAP1CYP1A2SIGMAR1KDM4EMETAP2
SCHEMBL14398008 0.86 CYP1A2 (0.46) METAP1CYP1A2SIGMAR1KDM4EMETAP2
SCHEMBL28126617 0.85 METAP1 (0.41) METAP1CYP1A2SIGMAR1KDM4EMETAP2
SCHEMBL7903931 0.85 CYP1A2 (0.57) METAP1CYP1A2SIGMAR1METAP2
SCHEMBL11739573 0.85 METAP1 (0.42) METAP1CYP1A2SIGMAR1KDM4EHPGD
SCHEMBL2580715 0.84 METAP1 (0.50) METAP1CYP1A2SIGMAR1HPGDMETAP2

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
US-4826815-A HYPOTENSIVE ABBOTT LABORATORIES (US) 1989-05-02 US disclosed