SCHEMBL8216348

SCHEMBL8216348

COCc1ccccc1S

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 3/20 0.38
PDK2 Q15119 1/20 0.37
MEN1 O00255 2/20 0.35
ALDH1A1 P00352 2/20 0.35
HTT P42858 2/20 0.35
KMT2A Q03164 2/20 0.35
NPSR1 Q6W5P4 2/20 0.35
TSHR P16473 1/20 0.35
PRKCE Q02156 2/20 0.33
MYLK Q15746 2/20 0.33
PRKCG P05129 1/20 0.33
MAPT P10636 1/20 0.33
PRKCA P17252 1/20 0.33
APEX1 P27695 1/20 0.33
RECQL P46063 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
ADRA1A P35348 1/20 0.33
FFAR1 O14842 1/20 0.33
KDM4E B2RXH2 1/20 0.33
NPC1 O15118 1/20 0.33

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
SCHEMBL20380886 0.83 IDO1 (0.33) IDO1ALDH1A1TDP1KDM4E
SCHEMBL648491 0.82 IDO1 (0.44) IDO1PDK2MEN1ALDH1A1HTT
SCHEMBL9094042 0.80 PDK2 (0.34) IDO1PDK2MEN1ALDH1A1HTT
SCHEMBL1025615 0.77 TSHR (0.38) IDO1ALDH1A1TSHRMAPTTDP1
SCHEMBL28070604 0.77 IDO1 (0.33) IDO1MEN1ALDH1A1KMT2ANPSR1
SCHEMBL5695153 0.76 IDO1 (0.41) IDO1PDK2MEN1ALDH1A1HTT
SCHEMBL734879 0.75 KCNN4 (0.46) IDO1PDK2MEN1ALDH1A1HTT
SCHEMBL256804 0.73 TAAR1 (0.48) ALDH1A1KMT2ATSHRADRA1AKDM4E
SCHEMBL20817185 0.73 CYP1A2 (0.44) MEN1ALDH1A1KMT2APRKCEMYLK
SCHEMBL29871264 0.73 CYP1A2 (0.44) MEN1ALDH1A1KMT2APRKCEMYLK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3049072-A1 SYNTHESIS OF DELTA 12-PGJ3 AND RELATED COMPOUNDS William Marsh Rice University (US) 2016-08-03 EP claimed
WO-2015048268-A1 SYNTHESIS OF DELTA 12-PGJ3 AND RELATED COMPOUNDS WILLIAM MARSH RICE UNIVERSITY (US) 2015-04-02 WO claimed
US-4225497-A ACID CATALYSTS FOR IMIDATION RHONE-POULENC INDUSTRIES (FR) 1980-09-30 US claimed
JP-2292259-A None JP disclosed
CN-112533934-B Polyoxometallate compounds exhibiting bright emissions and methods of making same 纳米2D材料有限公司 2024-07-19 CN disclosed
CN-113646354-A Curable composition and cured product thereof 引能仕株式会社 2021-11-12 CN disclosed
CN-112533934-A Polyoxometallate compounds exhibiting bright emission and methods of making the same 纳米2D材料有限公司 2021-03-19 CN disclosed
WO-2020185915-A1 ESTER SUBSTITUTED ION CHANNEL BLOCKERS AND METHODS FOR USE Nocion Therapeutics, Inc. (US) 2020-09-17 WO disclosed
US-20160318862-A1 SYNTHESIS OF DELTA 12-PGJ3 AND RELATED COMPOUNDS WILLIAM MARSH RICE UNIVERSITY (US) 2016-11-03 US disclosed
EP-3049072-A1 SYNTHESIS OF DELTA 12-PGJ3 AND RELATED COMPOUNDS William Marsh Rice University (US) 2016-08-03 EP disclosed
CN-101687781-B Compound for photoacid generator and use its anti-corrosion agent composition, pattern formation method CENTRAL GLASS CO.,LTD. (JP) 2015-08-12 CN disclosed
CN-101687781-A Compound for photoacid generator, resist composition using the same, and pattern-forming method CENTRAL GLASS CO LTD 2010-03-31 CN disclosed
EP-0767772-B1 NOVEL CHIRAL CYCLOHEXYL COMPOUNDS SECR DEFENCE (GB) 2000-08-30 EP disclosed
US-5853613-A Chiral cyclohexyl compounds SECRETARY OF STATE FOR DEFENCE IN HER BRITANNIC MAJESTY'S GOVERNMENT OF THE UNITED KINGDOM OF GREAT BRITAIN AND NORTHERN IRELAND (GB) 1998-12-29 US disclosed
EP-0795023-A1 A PROCESS FOR PRODUCING SULPHOXIDE ENRICHED IN THE (R) OR THE (S) ENANTIOMER ZENECA LIMITED (GB) 1997-09-17 EP disclosed
EP-0767772-A1 NOVEL CHIRAL CYCLOHEXYL COMPOUNDS THE SECRETARY OF STATE FOR DEFENCE (GB) 1997-04-16 EP disclosed
WO-1996017075-A1 A PROCESS FOR PRODUCING SULPHOXIDE ENRICHED IN THE (R) OR THE (S) ENANTIOMER ZENECA LIMITED (GB) 1996-06-06 WO disclosed
WO-1996000710-A1 NOVEL CHIRAL CYCLOHEXYL COMPOUNDS THE SECRETARY OF STATE FOR DEFENCE (GB) 1996-01-11 WO disclosed
JP-H02292259-A PRODUCTION OF 4-ALKOXYALKYL-4-AMINOPHENYLPIPERIDINE AND ITS DERIVATIVE BOC GROUP INC:THE 1990-12-03 JP disclosed
US-4225497-A ACID CATALYSTS FOR IMIDATION RHONE-POULENC INDUSTRIES (FR) 1980-09-30 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-20160318862-A1 SYNTHESIS OF DELTA 12-PGJ3 AND RELATED COMPOUNDS DGKZ, DGKG, DNAJA3 IDO1 3973/4885PDK2 300/4885MEN1 3731/4885

“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.