SCHEMBL8346108

SCHEMBL8346108

C[Ge](C)(C)c1cc(C(=O)Nc2ccc(C(=O)O)cc2)cc([Ge](C)(C)C)c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 5/20 0.60
MEN1 O00255 4/20 0.60
MITF O75030 1/20 0.56
FFAR1 O14842 1/20 0.54
CYP26A1 O43174 3/20 0.51
CYP3A4 P08684 3/20 0.51
RARA P10276 3/20 0.51
RARB P10826 2/20 0.51
RARG P13631 2/20 0.51
ALDH1A1 P00352 1/20 0.51
CYP1A2 P05177 1/20 0.51
CYP2C9 P11712 1/20 0.51
TSHR P16473 1/20 0.51
MAPK1 P28482 1/20 0.51
CYP2C19 P33261 1/20 0.51
PKM P14618 2/20 0.49
CA12 O43570 1/20 0.49
CA2 P00918 1/20 0.49
CA9 Q16790 1/20 0.49
HPSE Q9Y251 1/20 0.49

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
SCHEMBL8343720 0.88 MEN1 (0.54) KMT2AMEN1MITFFFAR1CYP26A1
SCHEMBL6242641 0.84 MEN1 (0.81) KMT2AMEN1MITFFFAR1CYP26A1
SCHEMBL8827340 0.80 MITF (0.81) KMT2AMEN1MITFFFAR1PKM
SCHEMBL28419632 0.80 MITF (0.81) KMT2AMEN1MITFFFAR1PKM
SCHEMBL900903 0.80 MITF (0.81) KMT2AMEN1MITFFFAR1PKM
SCHEMBL11732303 0.79 KMT2A (0.64) KMT2AMEN1MITFFFAR1CYP26A1
SCHEMBL8349995 0.78 HPSE (0.57) KMT2AMEN1FFAR1HPSERAB9A
SCHEMBL17849584 0.77 MEN1 (0.71) KMT2AMEN1MITFFFAR1CYP26A1
SCHEMBL11154646 0.77 NQO2 (0.76) KMT2AMEN1MITFFFAR1CYP26A1
SCHEMBL7620467 0.76 NPC1 (0.56) KMT2AMEN1MITFFFAR1CYP26A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-RE36477-E 4-(3,5-BIS(TRIMETHYLSILYLPHENYL)CARBOXAMIDO)BENZOIC ACID; DIFFERENTIATION-INDUCING REAGENT OR CELLS; ANTICARCINOGENTIC, -TUMOR,-INFLAMMATORY AND -PROLIFERATIVE AGENTS; PSORIASIS; LEUKEMIA; IMMUNOLOGY TAIHO PHARMACEUTICAL CO., LTD. (JP) 1999-12-28 US disclosed
EP-0337176-B1 Novel benzoic acid derivatives and process for preparing the same SHUDO KOICHI (JP) 1994-12-21 EP disclosed
US-5155249-A Differentiating neoplastic cells, treating psoriasis, immune or inflammatory diseases TAIHO PHARMACEUTICAL CO., LTD. (JP) 1992-10-13 US disclosed
US-5081271-A Differentiation-inducing agent for neoplastic cells; therapeutic agent for psoriasis or immune and inflammatory diseases TAIHO PHARMACEUTICAL CO., LTD. (JP) 1992-01-14 US disclosed
EP-0337176-A2 Novel benzoic acid derivatives and process for preparing the same Shudo, Koichi, Prof. Dr. (JP) 1989-10-18 EP disclosed