SCHEMBL10167730

SCHEMBL10167730

O=C(O)COc1cccc(C(=O)O)c1

nearest known ligand 0.65

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NR4A2 P43354 8/20 0.65
KMT2A Q03164 1/20 0.65
LMNA P02545 1/20 0.64
ALOX15 P16050 1/20 0.62
MAPK1 P28482 1/20 0.60
AKR1C3 P42330 1/20 0.59
PLA2G4B P0C869 1/20 0.58
PKM P14618 1/20 0.57
HTT P42858 1/20 0.57
NPC1 O15118 1/20 0.56
RAB9A P51151 1/20 0.56
PTPN7 P35236 1/20 0.56
NR4A1 P22736 1/20 0.54
NR4A3 Q92570 1/20 0.54

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
SCHEMBL413254 0.86 LMNA (0.81) KMT2ALMNAALOX15MAPK1PLA2G4B
SCHEMBL29953637 0.86 MAOB (0.67) KMT2ALMNAALOX15MAPK1PKM
SCHEMBL9448407 0.86 LMNA (0.60) NR4A2KMT2ALMNAALOX15MAPK1
SCHEMBL5839185 0.86 NR4A2 (0.66) NR4A2KMT2ALMNAAKR1C3PLA2G4B
SCHEMBL4060556 0.86 MAOB (0.67) KMT2ALMNAALOX15MAPK1PKM
SCHEMBL12168943 0.86 NR4A2 (0.61) NR4A2KMT2AAKR1C3PLA2G4BNPC1
SCHEMBL15093881 0.86 LMNA (0.60) NR4A2KMT2ALMNAALOX15MAPK1
SCHEMBL12411431 0.86 KMT2A (0.66) NR4A2KMT2ALMNAAKR1C3PLA2G4B
SCHEMBL1573075 0.86 NR4A2 (0.61) NR4A2KMT2AAKR1C3PLA2G4BNPC1
SCHEMBL5315044 0.86 ALOX15 (0.63) NR4A2KMT2ALMNAALOX15MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023187697-A1 PROCESS FOR THE PREPARATION OF BELUMOSUDIL MESYLATE AND ITS CRYSTALLINE FORM GLENMARK LIFE SCIENCES LIMITED (IN) 2023-10-05 WO disclosed
US-20210369850-A1 COMPOUNDS AND THERAPEUTIC USES THEREOF Centauri Therapeutics Limited (GB/GB) (GB) 2021-12-02 US disclosed
US-10953100-B2 Compounds and therapeutic uses thereof CENTUARI THERAPEUTICS LIMITED (GB/GB) (GB) 2021-03-23 US disclosed
US-20180280521-A1 COMPOUNDS AND THERAPEUTIC USES THEREOF CENTUARI THERAPEUTICS LIMITED (GB/GB) (GB) 2018-10-04 US disclosed
WO-2017060729-A1 COMPOUNDS AND THERAPEUTIC USES THEREOF CENTAURI THERAPEUTICS LIMITED (GB) 2017-04-13 WO disclosed
EP-2404918-B1 PYRIDINE DERIVATIVE AS PPARY INHIBITOR DAIICHI SANKYO CO LTD (JP) 2016-11-30 EP disclosed
US-8946264-B2 Pyridine derivative DAIICHI SANKYO COMPANY, LIMITED (JP) 2015-02-03 US disclosed
US-20130045994-A1 PYRIDINE DERIVATIVE DAIICHI SANKYO COMPANY, LIMITED (JP) 2013-02-21 US disclosed
US-20120029026-A1 PYRIDINE DERIVATIVE DAIICHI SANKYO COMPANY, LIMITED (JP) 2012-02-02 US disclosed
EP-0115403-B1 ABSORBABLE POLYMERS OF SUBSTITUTED BENZOIC ACID ETHICON, INC. (US) 1987-05-13 EP disclosed
US-4532928-A RADIATION STERILIZABLE ETHICON, INC. (US) 1985-08-06 US disclosed
US-4510295-A POLYESTER COPOLYMERS; FIBERS, SUTURES, SURGICAL PRODUCTS ETHICON, INC. (US) 1985-04-09 US disclosed
EP-0115403-A1 Absorbable polymers of substituted benzoic acid ETHICON, INC. (US) 1984-08-08 EP 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 (5 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-20210369850-A1 COMPOUNDS AND THERAPEUTIC USES THEREOF CD47, MYD88, NFATC1 NR4A2 3961/4885KMT2A 3670/4885LMNA 3909/4885
US-10953100-B2 Compounds and therapeutic uses thereof CD47, MYD88, NFATC1 NR4A2 3961/4885KMT2A 3670/4885LMNA 3909/4885
US-20120029026-A1 PYRIDINE DERIVATIVE PPARD, PPARG, PPARA NR4A2 435/4885KMT2A 3426/4885LMNA 3195/4885
US-20130045994-A1 PYRIDINE DERIVATIVE PPARD, PPARG, PPARA NR4A2 435/4885KMT2A 3426/4885LMNA 3195/4885
US-20180280521-A1 COMPOUNDS AND THERAPEUTIC USES THEREOF CD47, MYD88, NFATC1 NR4A2 3961/4885KMT2A 3670/4885LMNA 3909/4885

“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.