SCHEMBL11038720

SCHEMBL11038720

COCC1CCC(C2CCC(C(=O)Oc3ccc(F)c(Cl)c3)CC2)CC1

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ HPGD P15428 5/20 0.40
▸ PTGIR P43119 2/20 0.39
▸ SMN1; SMN2 Q16637 3/20 0.38
▸ HTT P42858 2/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ TDP1 Q9NUW8 1/20 0.38
▸ ALDH1A1 P00352 1/20 0.37
▸ L3MBTL1 Q9Y468 2/20 0.37
▸ NPC1 O15118 1/20 0.37
▸ MAPT P10636 1/20 0.37
▸ RAB9A P51151 1/20 0.37
▸ F2 P00734 1/20 0.37
▸ ATM Q13315 1/20 0.36
▸ CA2 P00918 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
SCHEMBL11038717 1.00 HPGD (0.40) HPGDPTGIRSMN1; SMN2HTTKMT2A
SCHEMBL11038715 1.00 HPGD (0.40) HPGDPTGIRSMN1; SMN2HTTKMT2A
SCHEMBL11034715 0.86 HPGD (0.40) HPGDSMN1; SMN2HTTKMT2ATDP1
SCHEMBL3285878 0.86 HPGD (0.40) HPGDSMN1; SMN2HTTKMT2ATDP1
SCHEMBL3277907 0.84 HPGD (0.38) HPGDSMN1; SMN2HTTKMT2ATDP1
SCHEMBL11037037 0.83 KMT2A (0.46) HPGDPTGIRSMN1; SMN2HTTKMT2A
SCHEMBL11035132 0.81 PTGIR (0.43) PTGIRKMT2AL3MBTL1
SCHEMBL11035130 0.81 PTGIR (0.43) PTGIRKMT2AL3MBTL1
SCHEMBL11035131 0.81 PTGIR (0.43) PTGIRKMT2AL3MBTL1
SCHEMBL9252992 0.81 HPGD (0.40) HPGDSMN1; SMN2HTTKMT2ATDP1

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
JP-59175453-A — — None — — JP disclosed
JP-S59175453-A 3,4-DIHALOGENOPHENYL ESTERE CHISSO CORP 1984-10-04 — — JP disclosed
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