SCHEMBL17898398

SCHEMBL17898398

CC1(C)CCCCC(=O)C1(C)C1CCCCCC1=O

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.48
KMT2A Q03164 2/20 0.40
CYP19A1 P11511 7/20 0.38
CA1 P00915 1/20 0.37
CA2 P00918 1/20 0.37
CA4 P22748 1/20 0.37
POLB P06746 1/20 0.32
CYP3A4 P08684 1/20 0.32
CYP2C19 P33261 1/20 0.32
CCR2 P41597 1/20 0.30

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
SCHEMBL17898397 0.81 CYP19A1 (0.42) HTTKMT2ACYP19A1CA1CA2
SCHEMBL27737741 0.75 HTT (0.49) HTTKMT2ACA1CA2CA4
SCHEMBL11799503 0.72 HTT (0.50) HTTKMT2ACYP19A1CA1CA2
SCHEMBL11790636 0.72 HTT (0.46) HTTKMT2ACYP19A1CA1CA2
SCHEMBL706322 0.72 HTT (0.50) HTTKMT2ACYP19A1CA1CA2
SCHEMBL9228569 0.72 HTT (0.43) HTTKMT2ACA1CA2CA4
SCHEMBL13176769 0.71 HTT (0.47) HTTKMT2ACYP19A1CA1CA2
SCHEMBL16362243 0.69 HTT (0.50) HTTKMT2ACYP19A1CA1CA2
SCHEMBL1238035 0.69 HTT (0.54) HTTKMT2ACYP19A1CA1CA2
SCHEMBL11790640 0.69 HTT (0.50) HTTKMT2ACYP19A1CA1CA2

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-9388048-B1 Synthesis of graphene by chemical vapor deposition UNIVERSITY OF SOUTHERN CALIFORNIA (US) 2016-07-12 US disclosed