SCHEMBL9627671

SCHEMBL9627671

CCc1c(OC)c(O)c2cccc(F)c2c1OC(C)=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.41
ALDH1A1 P00352 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
PDE4A P27815 1/20 0.39
PDE4B Q07343 1/20 0.39
PDE4C Q08493 1/20 0.39
PDE4D Q08499 1/20 0.39
HTT P42858 2/20 0.35
TP53 P04637 1/20 0.35
GAA P10253 1/20 0.35
MAPT P10636 1/20 0.35
HSD17B10 Q99714 1/20 0.35
ABCB11 O95342 1/20 0.35
BACE1 P56817 2/20 0.34
TUBB4A P04350 2/20 0.33
TUBB P07437 2/20 0.33
TUBA3C P0DPH7 2/20 0.33
TUBA1B P68363 2/20 0.33
TUBA4A P68366 2/20 0.33
TUBB4B P68371 2/20 0.33

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
SCHEMBL9629242 0.89 ALDH1A1 (0.40) KDM4EALDH1A1SMN1; SMN2HTTTP53
SCHEMBL9627706 0.87 KDM4E (0.45) KDM4EALDH1A1SMN1; SMN2PDE4APDE4B
SCHEMBL9629235 0.85 KDM4E (0.41) KDM4EALDH1A1SMN1; SMN2PDE4APDE4B
SCHEMBL9627915 0.83 PDE4A (0.41) KDM4EALDH1A1PDE4APDE4BPDE4C
SCHEMBL9628130 0.81 KDM4E (0.52) KDM4EALDH1A1SMN1; SMN2PDE4APDE4B
SCHEMBL9628196 0.81 ALDH1A1 (0.41) KDM4EALDH1A1SMN1; SMN2HTTTP53
SCHEMBL9656620 0.80 CTSV (0.35) KDM4EALDH1A1SMN1; SMN2GAAMAPT
SCHEMBL9629349 0.77 ALDH1A1 (0.40) KDM4EALDH1A1SMN1; SMN2HTTTP53
SCHEMBL9627562 0.75 PDE4A (0.41) KDM4EALDH1A1PDE4APDE4BPDE4C
SCHEMBL9629394 0.74 KDM4E (0.56) KDM4EALDH1A1SMN1; SMN2PDE4APDE4B

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5155132-A Nonsteroidal antiinflammatory agents; treating psoriasis SYNTEX (U.S.A.) INC. (US) 1992-10-13 US disclosed
US-5089657-A Topical antiinflammatory agents SYNTEX (U.S.A.) INC. (US) 1992-02-18 US disclosed
EP-0282056-A2 Naphthalene anti-psoriatic agents SYNTEX (U.S.A.) INC. (US) 1988-09-14 EP disclosed
EP-0282006-A1 Naphtalene anti-psoriatic agents SYNTEX (U.S.A.) INC. (US) 1988-09-14 EP disclosed
US-4758587-A Naphthalene anti-psoriatic agents SYNTEX (U.S.A.) INC. (US) 1988-07-19 US disclosed