SCHEMBL9558175

SCHEMBL9558175

Cc1cc(C)c(C(=O)O)c(C)c1Cc1ccc(C(=O)O)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 4/20 0.49
MEN1 O00255 3/20 0.49
LMNA P02545 1/20 0.49
SRD5A2 P31213 2/20 0.49
RXRA P19793 3/20 0.45
ALDH1A1 P00352 4/20 0.44
NR1H4 Q96RI1 1/20 0.42
THRB P10828 2/20 0.41
SMN1; SMN2 Q16637 2/20 0.41
KDM4E B2RXH2 2/20 0.41
USP2 O75604 1/20 0.41
POLB P06746 1/20 0.41
GAA P10253 1/20 0.41
MAPT P10636 1/20 0.41
NR4A1 P22736 1/20 0.41
APEX1 P27695 1/20 0.41
APOBEC3A P31941 1/20 0.41
RECQL P46063 1/20 0.41
HIF1A Q16665 1/20 0.41
APOBEC3G Q9HC16 1/20 0.41

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
SCHEMBL5163536 0.82 SRD5A2 (0.46) LMNASRD5A2ALDH1A1THRBSMN1; SMN2
SCHEMBL9558209 0.80 SRD5A2 (0.59) KMT2AMEN1LMNASRD5A2RXRA
SCHEMBL10455860 0.74 CYP3A4 (0.42) KMT2AMEN1LMNAALDH1A1SMN1; SMN2
SCHEMBL4052411 0.74 MEN1 (0.55) KMT2AMEN1LMNASRD5A2RXRA
SCHEMBL3290623 0.73 SMN1; SMN2 (0.43) KMT2AMEN1LMNAALDH1A1SMN1; SMN2
SCHEMBL18280483 0.73 CYP3A4 (0.41) KMT2AMEN1LMNAALDH1A1SMN1; SMN2
SCHEMBL3049097 0.72 THRA (0.61) KMT2AMEN1LMNASRD5A2RXRA
SCHEMBL5731826 0.72 KMT2A (0.49) KMT2AMEN1LMNASRD5A2RXRA
SCHEMBL30366057 0.72 RXRA (0.41) SRD5A2RXRAALDH1A1SMN1; SMN2KDM4E
Terephthalic Acid SCHEMBL7823824 0.72 ALDH1A1 (0.56) KMT2AMEN1SRD5A2RXRAALDH1A1

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-0332425-B1 PROCESS FOR REFINING 1,3-DIMETHYL-2-IMIDAZOLIDINONE AND A PROCESS FOR PREPARING AN AROMATIC POLYAMIDE BY USE OF THE REFINED PRODUCT MITSUI TOATSU CHEMICALS, Inc. (JP) 1993-01-27 EP disclosed
US-5075406-A Solution polymerization of polyamides in solvent purified by adsorption on magnesia, alumina, silica or mixed oxides MITSUI TOATSU CHEMICALS, INC. (JP) 1991-12-24 US disclosed
US-5011936-A Using composite salt consisting of at least two of silica, magnesia and alumina MITSUI TOATSU CHEMICALS, INC. (JP) 1991-04-30 US disclosed
US-4923951-A DIISOCYANTE, ALKALI OR ALKALINE EARTH METAL CATALYST MITSUI TOATSU CHEMICALS, INCORPORATED (JP) 1990-05-08 US disclosed