SCHEMBL2500845

SCHEMBL2500845

CC(=O)Nc1ccc(C(=O)O)c(C(=O)O)c1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MYC P01106 1/20 0.61
KDM4E B2RXH2 2/20 0.59
SMN1; SMN2 Q16637 2/20 0.54
POLB P06746 2/20 0.53
HTT P42858 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.52
NAPRT Q6XQN6 1/20 0.52
HSD17B10 Q99714 1/20 0.52
CYP1A2 P05177 1/20 0.51
CYP2C19 P33261 1/20 0.51
NPSR1 Q6W5P4 1/20 0.51
KMT2A Q03164 3/20 0.50
MAPT P10636 3/20 0.50
NPC1 O15118 2/20 0.50
RAB9A P51151 2/20 0.50
MEN1 O00255 2/20 0.50
TDP1 Q9NUW8 1/20 0.50
TAAR1 Q96RJ0 1/20 0.50
CDK1 P06493 1/20 0.50
GLA P06280 1/20 0.50

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
SCHEMBL11803827 0.85 KDM4E (0.67) MYCKDM4ESMN1; SMN2HTTL3MBTL1
SCHEMBL729994 0.85 SMN1; SMN2 (0.70) MYCKDM4ESMN1; SMN2POLBL3MBTL1
SCHEMBL31619607 0.85 KDM4E (0.66) MYCKDM4ESMN1; SMN2POLBHSD17B10
SCHEMBL377804 0.85 MYC (0.58) MYCKDM4ESMN1; SMN2POLBHTT
SCHEMBL2499018 0.85 KDM4E (0.66) MYCKDM4ESMN1; SMN2POLBHSD17B10
SCHEMBL30076649 0.85 KDM4C (0.62) MYCKDM4ESMN1; SMN2POLBHSD17B10
SCHEMBL170522 0.85 KDM4C (0.62) MYCKDM4ESMN1; SMN2POLBHSD17B10
SCHEMBL976774 0.85 MPO (0.58) MYCKDM4ESMN1; SMN2POLBHTT
SCHEMBL11804736 0.83 SMN1; SMN2 (0.68) MYCKDM4ESMN1; SMN2POLBL3MBTL1
SCHEMBL258439 0.83 MYC (0.56) MYCKDM4ESMN1; SMN2POLBHTT

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 27 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2019073431-A1 AN IMPROVED PROCESS FOR THE PREPARATION OF APREMILAST AND ITS INTERMEDIATE Piramal Enterprises Limited (IN) 2019-04-18 WO claimed
US-5830931-A DYEING SYNTHETIC HYDROPHOBIC MATERIAL BAYER AKTIENGESELLSCHAFT (DE) 1998-11-03 US claimed
CN-116925381-A Bimetallic MOF material and preparation method and application thereof 闽南科技学院 2023-10-24 CN disclosed
WO-2019073431-A1 AN IMPROVED PROCESS FOR THE PREPARATION OF APREMILAST AND ITS INTERMEDIATE Piramal Enterprises Limited (IN) 2019-04-18 WO disclosed
US-RE45685-E1 Pharmaceutically active isoindoline derivatives CELGENE CORPORATION (US) 2015-09-29 US disclosed
US-8030343-B2 Pharmaceutically active isoindoline derivatives CELGENE CORPORATION (US) 2011-10-04 US disclosed
US-7678825-B2 Pharmaceutically active isoindoline derivates CELGENE CORPORATION (US) 2010-03-16 US disclosed
EP-1228071-B1 PHARMACEUTICALLY ACTIVE ISOINDOLINE DERIVATIVES CELGENE CORP (US) 2007-03-28 EP disclosed
US-20040147588-A1 Pharmaceutically active isoindoline derivatives MAN HON-WAH 2004-07-29 US disclosed
US-6667316-B1 Amido or imido functionality; tumor necrosis factor alpha, phosphodiesterases, matrix metalloproteases and angiogenesis inhibitors CELGENE CORPORATION 2003-12-23 US disclosed
EP-0780444-B1 Process to manufacture polycyclic compounds BAYER AG (DE) 2001-09-05 EP disclosed
EP-0639624-A1 Phthaloperinone dyestuffs BAYER AG (DE) 1995-02-22 EP disclosed
US-5300479-A Pre-and postemergence herbicides AMERICAN CYANAMID COMPANY (US) 1994-04-05 US disclosed
US-5252560-A Cyclic imide derivatives, compositions and use GLAXO INC. (US) 1993-10-12 US disclosed
EP-0520573-A1 Cyclic imide derivatives GLAXO INC. (US) 1992-12-30 EP disclosed
US-5108485-A Controlling monocotyledonous and dicotyledonous plants AMERICAN CYANAMID COMPANY (US) 1992-04-28 US disclosed
EP-0474991-A1 Herbicidal 2-(2-imidazolin -2-yl)-benzazoles AMERICAN CYANAMID COMPANY (US) 1992-03-18 EP disclosed
US-4492796-A Isoindolenine derivatives, processes for their preparation and their use as intermediate products for the preparation of dyestuffs BAYER AKTIENGESELLSCHAFT (DE) 1985-01-08 US disclosed
US-4088651-A Acylamino quinophthalone compounds BAYER AKTIENGESELLSCHAFT (DT) 1978-05-09 US disclosed
US-3966726-A Process for the production of cyclic carboxylic acid imides AKZO N.V. (NL) 1976-06-29 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 (1 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-20040147588-A1 Pharmaceutically active isoindoline derivatives PDE3A, PDE5A, PDE2A MYC 3655/4885KDM4E 771/4885SMN1; SMN2 1013/4885

“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.