SCHEMBL10017853

SCHEMBL10017853

NC(=O)C1=C(C(=O)O)CCC1

nearest known ligand 0.46

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 1/20 0.46
PARP15 Q460N3 1/20 0.46
PARP10 Q53GL7 1/20 0.46
DHODH Q02127 6/20 0.39
FABP4 P15090 2/20 0.33
FABP5 Q01469 2/20 0.33
ALDH1A1 P00352 4/20 0.32
KDM4E B2RXH2 2/20 0.32
MEN1 O00255 2/20 0.32
MAPT P10636 2/20 0.32
KMT2A Q03164 2/20 0.32
RECQL P46063 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
HPGD P15428 1/20 0.31
ALOX15 P16050 1/20 0.31
MAPK1 P28482 1/20 0.31
HSD17B10 Q99714 1/20 0.31
OAT P04181 1/20 0.30

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
SCHEMBL4447755 0.95 PARP1 (0.42) PARP1PARP15PARP10DHODHFABP4
SCHEMBL4334172 0.95 PARP1 (0.42) PARP1PARP15PARP10DHODHFABP4
SCHEMBL10954847 0.89 PARP1 (0.37) PARP1PARP15PARP10ALDH1A1MAPT
SCHEMBL12475847 0.89 ALDH1A1 (0.37) PARP1PARP15PARP10DHODHALDH1A1
SCHEMBL252263 0.86 DHODH (0.45) PARP1PARP15PARP10DHODHFABP4
SCHEMBL4447758 0.83 ALDH1A1 (0.37) PARP1PARP15PARP10ALDH1A1KDM4E
SCHEMBL17024327 0.80 DHODH (0.41) PARP1PARP15PARP10DHODHFABP4
SCHEMBL17024326 0.80 DHODH (0.41) PARP1PARP15PARP10DHODHFABP4
SCHEMBL217840 0.80 DHODH (0.41) PARP1PARP15PARP10DHODHFABP4
SCHEMBL12491709 0.80 DHODH (0.41) PARP1PARP15PARP10DHODHFABP4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4531834-A1 TREATMENT OF ULCERATIVE COLITIS COMPRISING VIDOFLUDIMUS OR A PHARMACEUTICALLY ACCEPTABLE SALT THEREOF Immunic AG (DE) 2025-04-09 EP disclosed
WO-2023232884-A1 TREATMENT OF ULCERATIVE COLITIS COMPRISING VIDOFLUDIMUS OR A PHARMACEUTICALLY ACCEPTABLE SALT THEREOF IMMUNIC AG (DE) 2023-12-07 WO disclosed
CN-108676076-A The method for preparing guanosine cyclic mono-phosphate agonist 辛纳吉制药公司 2018-10-19 CN disclosed
CN-107090016-A The method for preparing guanosine cyclic mono-phosphate activator 辛纳吉制药公司 2017-08-25 CN disclosed
US-8653138-B2 Calcium salts of compounds as anti-inflammatory, immunomodulatory and anti-proliferatory agents 4SC MG (DE) 2014-02-18 US disclosed
US-20120035175-A1 Novel salts as Anti-Inflammatory, Immunomodulatory and Anti-Proliferatory Agents 4SC AG (DE) 2012-02-09 US disclosed
US-20120029034-A1 Novel calcium salts of Compound as Anti-Inflammatory, Immunomodulatory and Anti-Proliferatory Agents 4SC AG (DE) 2012-02-02 US disclosed
US-7645771-B2 CCR5 antagonists as therapeutic agents SMITHKLINE BEECHAM CORP. (US) 2010-01-12 US disclosed
US-7645771-B2 CCR5 antagonists as therapeutic agents SMITHKLINE BEECHAM CORP. (US) 2010-01-12 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 (2 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-20120029034-A1 Novel calcium salts of Compound as Anti-Inflammatory, Immunomodulatory and Anti-Proliferatory Agents PPARD, PPARG, PPARA PARP1 2501/4885PARP15 3232/4885PARP10 2828/4885
US-20120035175-A1 Novel salts as Anti-Inflammatory, Immunomodulatory and Anti-Proliferatory Agents ARG1, CD14, RXRG PARP1 2678/4885PARP15 3566/4885PARP10 3389/4885

“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.