SCHEMBL9627702

SCHEMBL9627702

CCOc1cc(O)c2c(OC)cccc2c1OC(=O)C(C)(C)C

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CTSV O60911 1/20 0.40
ANTXR2 P58335 1/20 0.40
KCNK3 O14649 1/20 0.39
KCNK9 Q9NPC2 1/20 0.39
TUBB1 Q9H4B7 1/20 0.38
TSHR P16473 1/20 0.36
ESR1 P03372 1/20 0.36
ESR2 Q92731 1/20 0.36
ELANE P08246 1/20 0.36
MAPK1 P28482 1/20 0.36
KDM4E B2RXH2 1/20 0.36
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
MAOA P21397 1/20 0.36
PPARG P37231 1/20 0.36
CALM1 P0DP23 1/20 0.36
PDE4A P27815 1/20 0.35
PDE4B Q07343 1/20 0.35
PDE4C Q08493 1/20 0.35
PDE4D Q08499 1/20 0.35

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
SCHEMBL9629345 0.83 ALDH1A1 (0.41) TSHRMAPK1KDM4EPPARGADORA3
SCHEMBL9660319 0.81 ELANE (0.39) KCNK3KCNK9TSHRELANEMAPK1
SCHEMBL9629350 0.78 SLC2A1 (0.42) TSHRELANEKDM4EGAAMAPT
SCHEMBL9654692 0.78 PPARG (0.46) CTSVANTXR2KCNK3KCNK9TUBB1
SCHEMBL9627373 0.77 ELANE (0.44) TSHRELANE
SCHEMBL9642741 0.77 ELANE (0.43) CTSVESR1ESR2ELANEKDM4E
SCHEMBL9627475 0.77 CTSV (0.49) CTSVANTXR2TUBB1ESR1ESR2
SCHEMBL9628509 0.77 PTPN1 (0.45) KCNK3KCNK9TSHRMAPK1KDM4E
SCHEMBL9642309 0.76 MAPT (0.41) CTSVESR1ESR2ELANEMAPK1
SCHEMBL9642729 0.75 GAA (0.39) TSHRELANEGAAMAPT

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-0282006-A1 Naphtalene anti-psoriatic agents SYNTEX (U.S.A.) INC. (US) 1988-09-14 EP disclosed
EP-0282056-A2 Naphthalene 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