SCHEMBL7734474

SCHEMBL7734474

CC(C)(C)C1CCCCC1c1ccc(O)cc1

nearest known ligand 0.42

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ ESR2 Q92731 15/20 0.42
▸ ESR1 P03372 8/20 0.42
▸ KDM1A O60341 1/20 0.40
▸ SLC6A2 P23975 1/20 0.39
▸ MEN1 O00255 1/20 0.37
▸ KMT2A Q03164 1/20 0.37

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
SCHEMBL1983886 0.81 KDM1A (0.50) ESR2ESR1KDM1AMEN1KMT2A
SCHEMBL11860489 0.79 KMT2A (0.48) ESR2ESR1KDM1AMEN1KMT2A
SCHEMBL11865942 0.77 ESR2 (0.52) ESR2ESR1KDM1AMEN1KMT2A
SCHEMBL9861182 0.76 ESR2 (0.48) ESR2ESR1KDM1AMEN1KMT2A
SCHEMBL10486574 0.74 ESR2 (0.47) ESR2ESR1KDM1AMEN1KMT2A
SCHEMBL16883880 0.74 ESR2 (0.47) ESR2ESR1KDM1AMEN1KMT2A
SCHEMBL16883879 0.72 KDM1A (0.42) ESR2ESR1KDM1AMEN1KMT2A
SCHEMBL19343309 0.72 KDM1A (0.42) ESR2ESR1KDM1AMEN1KMT2A
SCHEMBL17764171 0.72 KDM1A (0.42) ESR2ESR1KDM1AMEN1KMT2A
SCHEMBL16885987 0.72 KDM1A (0.42) ESR2ESR1KDM1AMEN1KMT2A

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-6403652-B1 A METHOD FOR INHIBITING METHICILLIN DRUG RESISTANT BACTERIA USING A PHENOLIC COMPOUND. COLGATE-PALMOLIVE COMPANY 2002-06-11 — — US disclosed
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