SCHEMBL9989638

SCHEMBL9989638

CCC(O)OC(=O)c1cccc(C(=O)O)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.46
CA12 O43570 1/20 0.46
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
CA6 P23280 1/20 0.46
CA9 Q16790 1/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
MRGPRX4 Q96LA9 2/20 0.46
TP53 P04637 1/20 0.46
PKM P14618 1/20 0.46
NFKB1 P19838 1/20 0.46
NFKB2 Q00653 1/20 0.46
RELA Q04206 1/20 0.46
ALDH1A1 P00352 1/20 0.43
NPC1 O15118 2/20 0.42
RAB9A P51151 2/20 0.42
MAPT P10636 1/20 0.42
HTT P42858 1/20 0.42
NR1H4 Q96RI1 1/20 0.42
MITF O75030 1/20 0.42

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
SCHEMBL3088428 0.93 MAPT (0.43) KMT2ACA12CA1CA2CA9
SCHEMBL2185343 0.88 KMT2A (0.48) KMT2ACA12CA1CA2CA6
SCHEMBL3358299 0.87 MAPT (0.44) KMT2ACA12CA1CA2CA6
SCHEMBL7181546 0.85 PRKCA (0.48) KMT2ACA12CA1CA2CA6
SCHEMBL344615 0.84 TSHR (0.55) KMT2ASMN1; SMN2TP53ALDH1A1NPC1
SCHEMBL3711959 0.84 KMT2A (0.46) KMT2ASMN1; SMN2MRGPRX4TP53PKM
SCHEMBL3877617 0.84 PLA2G4B (0.45) KMT2ATP53ALDH1A1NR1H4
SCHEMBL2160586 0.83 MAPT (0.56) KMT2ACA12CA1CA2CA9
SCHEMBL7917046 0.81 SMN1; SMN2 (0.49) KMT2ACA12CA1CA2CA6
SCHEMBL6228773 0.81 KMT2A (0.44) KMT2ACA12CA1CA2CA6

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
WO-2011158102-A1 CONTINUOUS PROCESS FOR THE PRODUCTION OF POLYESTER RESINS SUITABLE AS BINDERS FOR COMPATIBLE THERMOSETTING PAINTS ANS PAINTS BASED ON SAID POLYESTER RESINS ALCEA - AZIENDA LOMBARDA COLORI E AFFINI S.R.L. (IT) 2011-12-22 WO claimed
WO-2011158102-A1 CONTINUOUS PROCESS FOR THE PRODUCTION OF POLYESTER RESINS SUITABLE AS BINDERS FOR COMPATIBLE THERMOSETTING PAINTS ANS PAINTS BASED ON SAID POLYESTER RESINS ALCEA - AZIENDA LOMBARDA COLORI E AFFINI S.R.L. (IT) 2011-12-22 WO disclosed
CN-1498203-A Sophthalic acid glycol ester solution ��Ļ���Ű˾ 2004-05-19 CN disclosed
US-4045527-A MIXING POLYTETRAMETHYLENE GLYCOL RESIN PREPOLYMER WITH A DIISOCYANATE, A METAL SALT CURING CATALYST, AND A TETRAALKANOL AMINE CURING AGENT HITCO (US) 1977-08-30 US disclosed