SCHEMBL9204876

SCHEMBL9204876

CC(O)(Cc1ccccc1)c1ccc2c(c1)CCCN2

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 2/20 0.48
▸ KDM4E B2RXH2 2/20 0.45
▸ MAPT P10636 2/20 0.45
▸ ACHE P22303 5/20 0.43
▸ ALDH1A1 P00352 1/20 0.42
▸ LMNA P02545 1/20 0.42
▸ TP53 P04637 1/20 0.42
▸ THRB P10828 1/20 0.42
▸ ALOX15 P16050 1/20 0.42
▸ CASP1 P29466 1/20 0.42
▸ HTT P42858 1/20 0.42
▸ CASP7 P55210 1/20 0.42
▸ HSD17B10 Q99714 1/20 0.42
▸ TDP1 Q9NUW8 1/20 0.42
▸ CA12 O43570 1/20 0.38
▸ CA1 P00915 1/20 0.38
▸ CA2 P00918 1/20 0.38
▸ CA9 Q16790 1/20 0.38
▸ MAOA P21397 1/20 0.36
▸ MAOB P27338 1/20 0.36

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
SCHEMBL761229 0.76 GAA (0.53) GAAKDM4EMAPTALDH1A1LMNA
SCHEMBL17775050 0.75 CYP2C19 (0.56) ALDH1A1LMNANR3C2
SCHEMBL17775053 0.74 CYP1A2 (0.47) LMNANR3C2
SCHEMBL8737631 0.74 MAPT (0.52) GAAKDM4EMAPTACHEALDH1A1
SCHEMBL24347717 0.73 GAA (0.51) GAAKDM4EMAPTACHEALDH1A1
SCHEMBL9150274 0.72 MAPT (0.59) GAAKDM4EMAPTACHEALDH1A1
SCHEMBL13814905 0.72 MAPT (0.50) GAAKDM4EMAPTACHEALDH1A1
SCHEMBL3583487 0.72 CYP2C19 (0.61) LMNANR3C2
SCHEMBL11211304 0.72 CYP2C19 (0.61) LMNANR3C2
SCHEMBL19185633 0.71 GAA (0.49) GAAKDM4EMAPTACHEALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0525111-B1 ANTIINFLAMMATORY HYDROXAMIC ACIDS AND N-HYDROXYUREAS PFIZER (US) 1995-06-14 — — EP disclosed
US-5256789-A Antiinflammatory hydroxamic acids and N-hydroxyureas PFIZER INC. (US) 1993-10-26 — — US disclosed
EP-0525111-A1 ANTIINFLAMMATORY HYDROXAMIC ACIDS AND N-HYDROXYUREAS. PFIZER (US) 1993-02-03 — — EP disclosed
WO-1991016298-A1 ANTIINFLAMMATORY HYDROXAMIC ACIDS AND N-HYDROXYUREAS PFIZER INC (US) 1991-10-31 — — WO disclosed
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