SCHEMBL11479129

SCHEMBL11479129

COC(=O)Cc1ccc2cc(OC)ccc2c1Cl

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.52
ALDH1A1 P00352 2/20 0.52
HPGD P15428 1/20 0.52
AKR1C3 P42330 3/20 0.47
CYP11B1 P15538 1/20 0.47
CYP11B2 P19099 1/20 0.47
PTGS1 P23219 1/20 0.46
AKR1C2 P52895 1/20 0.46
SLC2A1 P11166 1/20 0.45
MTNR1A P48039 3/20 0.45
MTNR1B P49286 2/20 0.45
LMNA P02545 1/20 0.44
GAA P10253 1/20 0.44
MAPT P10636 1/20 0.44
TUBB4A P04350 1/20 0.42
TUBB P07437 1/20 0.42
TUBA3C P0DPH7 1/20 0.42
TUBA1B P68363 1/20 0.42
TUBA4A P68366 1/20 0.42
TUBB4B P68371 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
SCHEMBL11776294 0.88 ALDH1A1 (0.47) KDM4EALDH1A1HPGDAKR1C3PTGS1
SCHEMBL11600360 0.87 PTGS1 (0.57) KDM4EALDH1A1HPGDAKR1C3CYP11B1
SCHEMBL11779794 0.86 MTNR1A (0.49) KDM4EALDH1A1AKR1C3PTGS1AKR1C2
SCHEMBL11783277 0.86 MTNR1A (0.49) KDM4EALDH1A1AKR1C3PTGS1AKR1C2
SCHEMBL11460410 0.86 AKR1C3 (0.41) KDM4EALDH1A1HPGDAKR1C3GAA
SCHEMBL9504259 0.84 KDM4E (0.53) KDM4EALDH1A1HPGDAKR1C3CYP11B1
SCHEMBL11463686 0.84 TUBB4A (0.55) KDM4EALDH1A1HPGDAKR1C3CYP11B1
SCHEMBL11460184 0.84 ALDH1A1 (0.51) KDM4EALDH1A1HPGDAKR1C3GAA
SCHEMBL11472665 0.84 KDM4E (0.40) KDM4EALDH1A1HPGDAKR1C3LMNA
SCHEMBL11460167 0.84 SLC2A1 (0.58) KDM4EALDH1A1HPGDAKR1C3CYP11B1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4207241-A ANALGESICS, ANTIPYRETICS, ANTIINFLAMMATORY AGENTS AND ANTIPRURITIC AGENTS SYNTEX CORPORATION (US) 1980-06-10 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