SCHEMBL8459098

SCHEMBL8459098

C=CC(C)(C)C1=C(OC)C(=O)c2ccccc2C1=O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 13/20 0.55
▸ ALDH1A1 P00352 10/20 0.55
▸ KDM4E B2RXH2 8/20 0.55
▸ HPGD P15428 8/20 0.55
▸ POLB P06746 7/20 0.55
▸ LMNA P02545 7/20 0.55
▸ SMN1; SMN2 Q16637 5/20 0.55
▸ TDP1 Q9NUW8 5/20 0.55
▸ RAB9A P51151 5/20 0.55
▸ CDC25A P30304 3/20 0.55
▸ CDC25B P30305 3/20 0.55
▸ MAP2K7 O14733 1/20 0.55
▸ GMNN O75496 1/20 0.55
▸ TP53 P04637 1/20 0.55
▸ CYP1A2 P05177 1/20 0.55
▸ CYP3A4 P08684 1/20 0.55
▸ CYP2D6 P10635 1/20 0.55
▸ CYP2C9 P11712 1/20 0.55
▸ ALOX15 P16050 1/20 0.55
▸ CYP2C19 P33261 1/20 0.55

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
SCHEMBL8446033 0.81 APEX1 (0.38) MAPTALDH1A1KDM4EHPGDPOLB
SCHEMBL29359488 0.81 APEX1 (0.38) MAPTALDH1A1KDM4EHPGDPOLB
SCHEMBL9629357 0.80 MAPT (0.65) MAPTALDH1A1KDM4EHPGDPOLB
SCHEMBL4784189 0.78 APAF1 (0.50) MAPTALDH1A1KDM4EHPGDPOLB
SCHEMBL8463187 0.74 ALDH1A1 (0.33) MAPTALDH1A1KDM4EHPGDPOLB
SCHEMBL29355977 0.73 DHODH (0.51) MAPTALDH1A1KDM4EPOLBLMNA
SCHEMBL29545010 0.73 MAPT (1.00) MAPTALDH1A1KDM4EHPGDPOLB
SCHEMBL571557 0.73 MAPT (1.00) MAPTALDH1A1KDM4EHPGDPOLB
SCHEMBL15289027 0.72 MAPT (0.63) MAPTALDH1A1KDM4EHPGDPOLB
SCHEMBL21232268 0.70 MAPT (0.50) MAPTALDH1A1KDM4EHPGDPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5962002-A 1,1,4,4-SUBSTITUTED DIHYDRONAPHTHALENE COMPOUNDS BTG INTERNATIONAL LIMITED (GB) 1999-10-05 — — US disclosed
EP-0802730-B1 PESTICIDAL COMPOUNDS BTG INT LTD (GB) 1999-06-23 — — EP disclosed
WO-1996021355-A1 PESTICIDAL COMPOUNDS BRITISH TECHNOLOGY GROUP LIMITED (GB) 1996-07-18 — — WO disclosed
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