SCHEMBL9737939

SCHEMBL9737939

C=CCc1ccc(Oc2ccc(S(=O)(=O)c3ccc(Oc4ccc(CC=C)cc4)cc3)cc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 8/20 0.52
▸ HTT P42858 7/20 0.52
▸ ALDH1A1 P00352 6/20 0.52
▸ LMNA P02545 4/20 0.52
▸ TP53 P04637 2/20 0.52
▸ TSHR P16473 2/20 0.52
▸ NPC1 O15118 2/20 0.52
▸ RAB9A P51151 2/20 0.52
▸ CYP3A4 P08684 1/20 0.52
▸ ALOX15 P16050 1/20 0.52
▸ ALOX12 P18054 1/20 0.52
▸ MAPT P10636 1/20 0.52
▸ XBP1 P17861 1/20 0.52
▸ MAPK1 P28482 1/20 0.52
▸ MDM2 Q00987 1/20 0.52
▸ HSD17B10 Q99714 1/20 0.52
▸ MMP2 P08253 1/20 0.45
▸ FFAR4 Q5NUL3 1/20 0.44
▸ POLB P06746 3/20 0.44
▸ PKM P14618 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
SCHEMBL636220 0.89 POLB (0.52) SMN1; SMN2ALDH1A1LMNATP53TSHR
SCHEMBL9352993 0.84 ALDH1A1 (0.68) SMN1; SMN2HTTALDH1A1LMNATP53
SCHEMBL88416 0.84 ALDH1A1 (0.68) SMN1; SMN2HTTALDH1A1LMNATP53
SCHEMBL2793675 0.82 ALDH1A1 (0.65) SMN1; SMN2HTTALDH1A1LMNATP53
SCHEMBL3744646 0.82 ALDH1A1 (0.65) SMN1; SMN2HTTALDH1A1LMNATP53
SCHEMBL11786266 0.80 POLB (0.50) SMN1; SMN2HTTALDH1A1LMNATP53
SCHEMBL4296258 0.79 ALDH1A1 (0.49) SMN1; SMN2HTTALDH1A1LMNATP53
SCHEMBL5606838 0.77 TSHR (0.59) SMN1; SMN2HTTALDH1A1TP53TSHR
SCHEMBL15822354 0.76 ALDH1A1 (0.53) SMN1; SMN2HTTALDH1A1LMNATP53
SCHEMBL28190734 0.76 BCHE (0.50) HTTTSHRMMP2POLBCA12

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-5145926-A Poly(indane ethers) ALLIED-SIGNAL INC. (US) 1992-09-08 — — US disclosed
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