SCHEMBL11083127

SCHEMBL11083127

Cc1cc(Oc2ccc(Cc3ccccc3)cc2)cc(C)c1N

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ LTA4H P09960 4/20 0.50
▸ SRD5A2 P31213 2/20 0.46
▸ GRIN1 Q05586 2/20 0.44
▸ GRIN2B Q13224 2/20 0.44
▸ PPARG P37231 1/20 0.43
▸ ST14 Q9Y5Y6 1/20 0.43
▸ IDH1 O75874 2/20 0.43
▸ MEN1 O00255 1/20 0.42
▸ NPC1 O15118 1/20 0.42
▸ RAB9A P51151 1/20 0.42
▸ KMT2A Q03164 1/20 0.42
▸ NLRP3 Q96P20 1/20 0.42
▸ ALDH1A1 P00352 2/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.42
▸ MAOA P21397 1/20 0.41
▸ ACACB O00763 1/20 0.41
▸ ACACA Q13085 1/20 0.41

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
SCHEMBL9680517 0.93 ST14 (0.48) LTA4HSRD5A2GRIN1GRIN2BPPARG
SCHEMBL5028191 0.84 LTA4H (0.52) LTA4HPPARGMEN1NPC1RAB9A
SCHEMBL29619541 0.81 ST14 (0.41) SRD5A2GRIN1GRIN2BST14IDH1
SCHEMBL9681696 0.80 BACE1 (0.42) LTA4HPPARGST14MEN1NPC1
SCHEMBL27509240 0.80 CALM1 (0.52) LTA4HIDH1ALDH1A1
SCHEMBL7178244 0.80 LTA4H (0.67) LTA4HSRD5A2GRIN1GRIN2BPPARG
SCHEMBL246373 0.80 LTA4H (0.67) LTA4HSRD5A2GRIN1GRIN2BPPARG
SCHEMBL11092258 0.80 LTA4H (0.46) LTA4HSRD5A2GRIN1GRIN2BIDH1
SCHEMBL8732491 0.78 MAOA (0.68) LTA4HSRD5A2GRIN1GRIN2BMEN1
SCHEMBL10269397 0.78 SRD5A2 (0.68) LTA4HSRD5A2GRIN1GRIN2BIDH1

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-4452795-A MITICIDES, INSECTICIDES CIBA-GEIGY CORPORATION (US) 1984-06-05 — — US disclosed
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