SCHEMBL29618685

SCHEMBL29618685

Cc1cc(C)c(OCC(O)COc2c(C)cc(C)c(C=O)c2C)c(C)c1C=O

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.39
GLA P06280 1/20 0.39
TSHR P16473 1/20 0.36
LMNA P02545 4/20 0.36
HTT P42858 2/20 0.34
MEN1 O00255 5/20 0.33
KMT2A Q03164 5/20 0.33
SCN5A Q14524 1/20 0.33
CYP2D6 P10635 1/20 0.33
S1PR1 P21453 1/20 0.33
S1PR3 Q99500 1/20 0.33
POLB P06746 2/20 0.33
NPSR1 Q6W5P4 1/20 0.33
SRC P12931 1/20 0.33
GAA P10253 1/20 0.32
HPGD P15428 1/20 0.32
KDM4E B2RXH2 1/20 0.32
CYP1A2 P05177 1/20 0.32

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
SCHEMBL21001639 1.00 MAPT (0.39) MAPTGLATSHRLMNAHTT
SCHEMBL20906675 0.79 GAA (0.37) TSHRLMNAMEN1KMT2ACYP2D6
SCHEMBL18622635 0.77 ALDH1A1 (0.35) MAPTLMNAMEN1KMT2APOLB
SCHEMBL20906749 0.77 MCL1 (0.40) HTTKMT2AHPGDKDM4E
SCHEMBL22379888 0.75 KDM4E (0.41) MAPTLMNAHTTMEN1KMT2A
SCHEMBL17281890 0.74 ALDH1A1 (0.49) GLANPSR1GAAKDM4ECYP1A2
SCHEMBL25836799 0.74 HTR1A (0.41) MAPTLMNAMEN1KMT2APOLB
SCHEMBL10504348 0.73 AKR1B1 (0.41) MAPTGLATSHRLMNAMEN1
SCHEMBL24982920 0.72 ALDH1A1 (0.40) MAPTLMNAMEN1KMT2ACYP2D6
SCHEMBL21001297 0.72 ALDH1A1 (0.41) MAPTGLATSHRLMNAMEN1

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
CN-111372923-B 1, 3-dipolar compounds comprising epoxy groups 米其林集团总公司 2023-06-23 CN disclosed
CN-111372790-B Diene polymers modified by epoxide groups 米其林集团总公司 2022-06-21 CN disclosed
CN-111356596-B Rubber composition 米其林集团总公司 2022-06-21 CN disclosed