SCHEMBL30438176

SCHEMBL30438176

O=C(O)c1cc(OCC2CC2)c2ccccc2n1

nearest known ligand 0.68

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 2/20 0.61
KMO O15229 2/20 0.46
RBP4 P02753 8/20 0.43
TTR P02766 5/20 0.43
ALDH1A1 P00352 1/20 0.43
HPGD P15428 1/20 0.43
HSD17B10 Q99714 1/20 0.43
POLB P06746 1/20 0.43
PTGER1 P34995 2/20 0.42
S1PR2 O95136 1/20 0.42
XDH P47989 1/20 0.42

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
SCHEMBL20515876 1.00 ALOX15 (0.61) ALOX15KMORBP4TTRALDH1A1
SCHEMBL30744837 0.88 ALOX15 (0.57) ALOX15RBP4TTRALDH1A1HPGD
SCHEMBL30744775 0.84 RBP4 (0.46) ALOX15KMORBP4TTRXDH
SCHEMBL9378807 0.81 ALOX15 (0.66) ALOX15ALDH1A1HPGDHSD17B10POLB
SCHEMBL18528819 0.81 ALOX15 (0.70) ALOX15ALDH1A1HPGDHSD17B10
SCHEMBL31389285 0.81 ALOX15 (0.70) ALOX15ALDH1A1HPGDHSD17B10
SCHEMBL2908552 0.80 ALOX15 (0.64) ALOX15PTGER1
SCHEMBL30438115 0.80 ALOX15 (0.64) ALOX15ALDH1A1HPGDHSD17B10
SCHEMBL31389237 0.80 ALOX15 (0.64) ALOX15PTGER1
SCHEMBL15022581 0.80 GRM4 (0.46) ALOX15KMO

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
CN-111295382-B Bridged bicyclic compounds as farnesyl ester X receptor modulators 百时美施贵宝公司 2024-02-02 CN claimed
CN-111278817-B Polycyclic compounds as farnesol X receptor modulators 百时美施贵宝公司 2023-05-16 CN claimed