SCHEMBL11996126

SCHEMBL11996126

CCC/N=C1\S/C(=C\c2ccc(O)c(OC)c2)C(=O)N1c1ccccc1

nearest known ligand 0.76

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ S1PR1 P21453 15/20 0.76
▸ S1PR3 Q99500 12/20 0.76
▸ FAAH O00519 2/20 0.74
▸ MEN1 O00255 2/20 0.60
▸ MAPT P10636 2/20 0.60
▸ KMT2A Q03164 2/20 0.60
▸ ALDH1A1 P00352 1/20 0.60
▸ GAA P10253 1/20 0.60
▸ ATM Q13315 1/20 0.60
▸ NPSR1 Q6W5P4 1/20 0.60
▸ IDE P14735 1/20 0.58
▸ MCL1 Q07820 1/20 0.58

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
SCHEMBL12382069 0.94 S1PR1 (0.77) S1PR1S1PR3FAAHMEN1MAPT
SCHEMBL12315656 0.91 S1PR1 (0.68) S1PR1S1PR3FAAHMEN1MAPT
SCHEMBL12315641 0.86 S1PR1 (1.00) S1PR1S1PR3
SCHEMBL19481508 0.85 FAAH (1.00) S1PR1S1PR3FAAHMEN1MAPT
SCHEMBL17309376 0.85 FAAH (1.00) S1PR1S1PR3FAAHMEN1MAPT
SCHEMBL12382068 0.84 S1PR1 (0.75) S1PR1S1PR3MEN1KMT2AALDH1A1
SCHEMBL12315629 0.81 S1PR1 (1.00) S1PR1S1PR3
SCHEMBL31310561 0.79 FAAH (0.83) S1PR1S1PR3FAAHMEN1MAPT
SCHEMBL12315643 0.78 S1PR1 (0.75) S1PR1S1PR3MEN1KMT2AALDH1A1
SCHEMBL16130327 0.78 S1PR1 (0.66) S1PR1S1PR3

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
US-8912340-B2 Process for the preparation of 2-imino-thiazolidin-4-one derivatives ACTELION PHARMACEUTICALS LTD. (CH) 2014-12-16 — — US disclosed
US-8912340-B2 Process for the preparation of 2-imino-thiazolidin-4-one derivatives ACTELION PHARMACEUTICALS LTD. (CH) 2014-12-16 — — US disclosed
EP-2489662-B1 Intermediates of a new process for the preparation of 5-benzylidene-2-alkylimino-3-phenylthiazolidin-4-one derivatives ACTELION PHARMACEUTICALS LTD (CH) 2014-08-06 — — EP disclosed
US-20120302758-A1 NEW PROCESS FOR THE PREPARATION OF 2-IMINO-THIAZOLIDIN-4-ONE DERIVATIVES VANDA PHARMACEUTICALS INC. 2012-11-29 — — US disclosed
US-20120302758-A1 NEW PROCESS FOR THE PREPARATION OF 2-IMINO-THIAZOLIDIN-4-ONE DERIVATIVES VANDA PHARMACEUTICALS INC. 2012-11-29 — — US disclosed
US-8263780-B2 Process for the preparation of 2-imino-thiazolidin-4-one derivatives ACTELION PHARMACEUTICALS LTD. (CH) 2012-09-11 — — US disclosed
US-8263780-B2 Process for the preparation of 2-imino-thiazolidin-4-one derivatives ACTELION PHARMACEUTICALS LTD. (CH) 2012-09-11 — — US disclosed
EP-2489662-A1 New process for the preparation of 2-imino-thiazolidin-4-one derivatives Actelion Pharmaceuticals Ltd. (CH) 2012-08-22 — — EP disclosed
US-20110201821-A2 NEW PROCESS FOR THE PREPARATION OF 2-IMINO-THIAZOLIDIN-4-ONE DERIVATES VANDA PHARMACEUTICALS INC. 2011-08-18 — — US disclosed
US-20110201821-A2 NEW PROCESS FOR THE PREPARATION OF 2-IMINO-THIAZOLIDIN-4-ONE DERIVATES VANDA PHARMACEUTICALS INC. 2011-08-18 — — US disclosed
US-20100317867-A1 NEW PROCESS FOR THE PREPARATION OF 2-IMINO-THIAZOLIDIN-4-ONE DERIVATIVES ACTELION PHARMACEUTICALS LTD. (CH) 2010-12-16 — — US disclosed
US-20100317867-A1 NEW PROCESS FOR THE PREPARATION OF 2-IMINO-THIAZOLIDIN-4-ONE DERIVATIVES ACTELION PHARMACEUTICALS LTD. (CH) 2010-12-16 — — US disclosed
WO-2008062376-A2 NEW PROCESS FOR THE PREPARATION OF 2-IMINO-THIAZOLIDIN-4-ONE DERIVATIVES ACTELION PHARMACEUTICALS LTD (CH) 2008-05-29 — — WO 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 (3 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-20100317867-A1 NEW PROCESS FOR THE PREPARATION OF 2-IMINO-THIAZOLIDIN-4-ONE DERIVATIVES IL4, IL15, IL2 S1PR1 3394/4885S1PR3 3399/4885FAAH 4751/4885
US-20110201821-A2 NEW PROCESS FOR THE PREPARATION OF 2-IMINO-THIAZOLIDIN-4-ONE DERIVATES IL4, IL2, IL15 S1PR1 3355/4885S1PR3 3539/4885FAAH 4677/4885
US-20120302758-A1 NEW PROCESS FOR THE PREPARATION OF 2-IMINO-THIAZOLIDIN-4-ONE DERIVATIVES IL4, IL15, IL2 S1PR1 3394/4885S1PR3 3399/4885FAAH 4751/4885

“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.

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