SCHEMBL9504259

SCHEMBL9504259

COC(=O)Cc1ccc2cc(OC)ccc2c1C

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.53
ALDH1A1 P00352 3/20 0.53
HPGD P15428 3/20 0.53
CYP11B1 P15538 1/20 0.48
CYP11B2 P19099 1/20 0.48
AKR1C3 P42330 3/20 0.47
PTGS1 P23219 1/20 0.47
AKR1C2 P52895 1/20 0.47
SLC2A1 P11166 1/20 0.46
MTNR1A P48039 3/20 0.46
MTNR1B P49286 2/20 0.46
GLA P06280 2/20 0.44
GAA P10253 1/20 0.44
TUBB4A P04350 1/20 0.43
TUBB P07437 1/20 0.43
TUBA3C P0DPH7 1/20 0.43
TUBA1B P68363 1/20 0.43
TUBA4A P68366 1/20 0.43
TUBB4B P68371 1/20 0.43
TUBB3 Q13509 1/20 0.43

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
SCHEMBL11479123 0.88 ALDH1A1 (0.44) KDM4EALDH1A1HPGDCYP11B1CYP11B2
SCHEMBL453836 0.87 AKR1C2 (0.59) KDM4EALDH1A1HPGDCYP11B1CYP11B2
SCHEMBL2169014 0.86 PTGS1 (0.47) KDM4EALDH1A1HPGDAKR1C3PTGS1
SCHEMBL11460167 0.86 SLC2A1 (0.58) KDM4EALDH1A1HPGDCYP11B1CYP11B2
SCHEMBL11463686 0.86 TUBB4A (0.55) KDM4EALDH1A1HPGDCYP11B1CYP11B2
SCHEMBL11460746 0.85 KDM4E (0.45) KDM4EALDH1A1HPGDGLAGAA
SCHEMBL11462322 0.84 KDM4E (0.52) KDM4EALDH1A1HPGDCYP11B1CYP11B2
SCHEMBL11479129 0.84 KDM4E (0.52) KDM4EALDH1A1HPGDCYP11B1CYP11B2
SCHEMBL11479610 0.83 SLC6A2 (0.45) KDM4EALDH1A1HPGDGLAGAA
SCHEMBL11462465 0.83 ALDH1A1 (0.43) KDM4EALDH1A1HPGDAKR1C3GLA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0547148-A1 NAPHTHALENEPROPIONIC ACID DERIVATIVES AS ANTI-INFLAMMATORY/ANTIALLERGIC AGENTS AMERICAN HOME PRODUCTS CORPORATION (US) 1993-06-23 EP disclosed
WO-1992004325-A1 NAPHTHALENEPROPIONIC ACID DERIVATIVES AS ANTI-INFLAMMATORY/ANTIALLERGIC AGENTS AMERICAN HOME PRODUCTS CORPORATION (US) 1992-03-19 WO disclosed
US-4207241-A ANALGESICS, ANTIPYRETICS, ANTIINFLAMMATORY AGENTS AND ANTIPRURITIC AGENTS SYNTEX CORPORATION (US) 1980-06-10 US disclosed
US-4097674-A ANTIINFLAMMATORY, ANTIPYRETIC, ANTIPRURITIC AGENTS, ANALGESICS SYNTEX CORPORATION (US) 1978-06-27 US disclosed
US-4051233-A ANTIINFLAMMATORY, ANALGESIC, ANTIPYRETIC, ANTIPRURITIC SYNTEX CORPORATION (US) 1977-09-27 US disclosed
US-4001301-A ANTIINFLAMMATORY AGENTS, ANALGESICS, ANTIPYRETICS, ANTI-PRURITIC SYNTEX CORPORATION (PM) 1977-01-04 US disclosed
US-3998966-A Anti-inflammatory, analgesic, anti-pyretic and anti-pruritic 6-substituted 2-naphthyl acetic acid derivative-containing compositions and methods of use thereof SYNTEX CORPORATION (PM) 1976-12-21 US disclosed
US-3980699-A ANTIINFLAMMATORY, ANALGESICS, ANTIPYRETIC, ANTIPRURITIC SYNTEX CORPORATION (PM) 1976-09-14 US disclosed
US-3978116-A ANALGESIC, ANTIPYRETIC SYNTEX CORPORATION (PM) 1976-08-31 US disclosed
US-3978124-A ANALGESIC, ANTIPYRETIC SYNTEX CORPORATION (PM) 1976-08-31 US disclosed