SCHEMBL3907975

SCHEMBL3907975

Cc1oc(C=O)cc1C(=O)O

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TTR P02766 2/20 0.58
MAPT P10636 3/20 0.49
APEX1 P27695 3/20 0.46
NPC1 O15118 4/20 0.45
RAB9A P51151 4/20 0.45
GLA P06280 1/20 0.45
POLB P06746 5/20 0.44
ALDH1A1 P00352 4/20 0.44
SMN1; SMN2 Q16637 3/20 0.44
L3MBTL1 Q9Y468 3/20 0.44
HPGD P15428 3/20 0.44
LDHA P00338 1/20 0.41
LDHB P07195 1/20 0.41
HAO1 Q9UJM8 1/20 0.41
KDM4E B2RXH2 5/20 0.41
LMNA P02545 1/20 0.41
HSD17B10 Q99714 4/20 0.41
MAPK1 P28482 1/20 0.41
TDP1 Q9NUW8 3/20 0.40
TP53 P04637 1/20 0.40

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
SCHEMBL29362618 0.82 TTR (0.57) TTRMAPTAPEX1NPC1RAB9A
SCHEMBL1936673 0.79 ALDH1A1 (0.48) TTRMAPTPOLBALDH1A1L3MBTL1
SCHEMBL12087063 0.79 KDM4E (0.40) TTRMAPTRAB9AGLAPOLB
SCHEMBL17582651 0.78 LDHA (0.42) TTRMAPTAPEX1POLBALDH1A1
SCHEMBL5357960 0.77 KDM4E (0.48) MAPTNPC1RAB9APOLBALDH1A1
SCHEMBL20805350 0.75 MAPT (0.44) TTRMAPTNPC1RAB9AALDH1A1
SCHEMBL18322309 0.74 TTR (1.00) TTRMAPTAPEX1NPC1RAB9A
SCHEMBL18322316 0.74 TTR (1.00) TTRMAPTAPEX1NPC1RAB9A
SCHEMBL546834 0.74 MAPT (0.59) TTRMAPTAPEX1NPC1RAB9A
SCHEMBL29072286 0.73 ALDH1A1 (0.42) TTRMAPTRAB9APOLBALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1701934-B1 DISUBSTITUTED CHALCONE OXIMES HAVING RAR(Gamma)-RETINOID RECEPTOR ANTAGONIST ACTIVITY ALLERGAN INC (US) 2009-02-25 EP disclosed
US-7476673-B2 Disubstituted chalcone oximes as selective agonists of RARγ retinoid receptors ALLERGAN, INC. (US) 2009-01-13 US disclosed
US-7432388-B2 Disubstituted chalcone oximes having RARγ retinoid receptor antagonist activity ALLERGAN, INC. (US) 2008-10-07 US disclosed
US-20080097119-A1 Disubstituted chalcone oximes having RARgamma retinoid receptor antagonist activity TSANG KWOK Y 2008-04-24 US disclosed
US-7253319-B2 Disubstituted chalcone oximes having RARγ retinoid receptor antagonist activity ALLERGAN, INC. (US) 2007-08-07 US disclosed
EP-1704139-A1 DISUBSTITUTED CHALCONE OXIMES AS SELECTIVE AGONISTS OF RAR y RETINOID RECEPTORS Allergan, Inc. (US) 2006-09-27 EP disclosed
EP-1701934-A2 DISUBSTITUTED CHALCONE OXIMES HAVING RAR(Gamma)-RETINOID RECEPTOR ANTAGONIST ACTIVITY Allergan, Inc. (US) 2006-09-20 EP disclosed
US-20050165095-A1 Disubstituted chalcone oximes having RARy retinoid receptor antagonist activity ALLERGAN, INC. 2005-07-28 US disclosed
WO-2005066116-A1 DISUBSTITUTED CHALCONE OXIMES AS SELECTIVE AGONISTS OF RARϜ RETINOID RECEPTORS ALLERGAN, INC. (US) 2005-07-21 WO disclosed
WO-2005066115-A2 DISUBSTITUTED CHALCONE OXIMES HAVING RARϜ RETINOID RECEPTOR ANTAGONIST ACTIVITY ALLERGAN, INC. (US) 2005-07-21 WO disclosed
US-20050148590-A1 Disubstituted chalcone oximes as selective agonists of RAR retinoid receptors ALLERGAN, INC. 2005-07-07 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080097119-A1 Disubstituted chalcone oximes having RARgamma retinoid receptor antagonist activity RARG, RARB, RARA TTR 2097/4885MAPT 4778/4885APEX1 4480/4885
US-20050165095-A1 Disubstituted chalcone oximes having RARy retinoid receptor antagonist activity RARB, RARG, RARA TTR 1587/4885MAPT 4700/4885APEX1 4482/4885
US-20050148590-A1 Disubstituted chalcone oximes as selective agonists of RAR retinoid receptors RARG, RXRG, RARB TTR 3454/4885MAPT 4165/4885APEX1 3176/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.