SCHEMBL9791983

SCHEMBL9791983

Cc1ccc(C2[C@]3(O)C(O)C(c4ccc(C(=O)NC(C)C)cc4)[C@]3(O)[C@]2(O)[C@H](O)CO)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.39
MEN1 O00255 4/20 0.38
KMT2A Q03164 4/20 0.38
SMN1; SMN2 Q16637 2/20 0.38
CCR1 P32246 1/20 0.35
ALDH1A1 P00352 3/20 0.34
LMNA P02545 2/20 0.34
CYP1A2 P05177 1/20 0.34
ALOX15 P16050 1/20 0.34
CYP2C19 P33261 1/20 0.34
PTGS2 P35354 1/20 0.34
MLYCD O95822 1/20 0.34
MAPK14 Q16539 1/20 0.34
TP53 P04637 1/20 0.33
MAPT P10636 1/20 0.33
ADRB2 P07550 1/20 0.33
ADRB1 P08588 1/20 0.33
ADRB3 P13945 1/20 0.33
KDM4E B2RXH2 1/20 0.32
GAA P10253 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
SCHEMBL9791992 0.96 ALDH1A1 (0.37) HPGDSMN1; SMN2ALDH1A1LMNACYP1A2
SCHEMBL9791969 0.91 MMP13 (0.40) HPGDMEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL9791912 0.87 L3MBTL1 (0.40) MEN1KMT2ASMN1; SMN2ALDH1A1LMNA
SCHEMBL9791972 0.86 RAB9A (0.43) HPGDMEN1KMT2ASMN1; SMN2ALDH1A1
SCHEMBL9792026 0.86 HPGD (0.35) HPGDSMN1; SMN2
SCHEMBL9792091 0.84 OPRD1 (0.35) HPGDMEN1KMT2ALMNAMAPK14
SCHEMBL8555125 0.82 ADRB2 (0.34) HPGDKMT2AALDH1A1MAPTADRB2
SCHEMBL5203790 0.82 ANXA2 (0.32) SMN1; SMN2TP53
SCHEMBL5201250 0.82 ANXA2 (0.32) SMN1; SMN2TP53
SCHEMBL8555860 0.82 NPC1 (0.37) HPGDMEN1KMT2ASMN1; SMN2ALDH1A1

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-4996334-A Dibenzylidenesorbitols for gelatinizing oils and liquids, increasing transparency and rigidity in resins, improving viscosity of coatings and stabilizing emulsions MITSUBISHI PETROCHEMICAL CO., LTD. (JP) 1991-02-26 US disclosed