SCHEMBL7068310

SCHEMBL7068310

CN1C(=O)C2=C(c3ccc(Cl)cc3)N(C)C(=O)C2=C1c1ccc(Cl)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 1/20 0.51
NOTUM Q6P988 1/20 0.42
ALDH1A1 P00352 6/20 0.39
GAA P10253 5/20 0.39
KDM4E B2RXH2 4/20 0.39
LMNA P02545 3/20 0.39
MEN1 O00255 3/20 0.39
KMT2A Q03164 3/20 0.39
HPGD P15428 1/20 0.39
CISD1 Q9NZ45 2/20 0.38
MAOB P27338 1/20 0.38
TSPO P30536 1/20 0.37
MAPT P10636 3/20 0.37
ALOX12 P18054 1/20 0.37
HTT P42858 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
CYP1A2 P05177 1/20 0.36
THRB P10828 1/20 0.35
TSHR P16473 1/20 0.35

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
SCHEMBL7064955 0.91 PTGS2 (0.45) PTGS2NOTUMALDH1A1GAAKDM4E
SCHEMBL29644733 0.82 PTGS2 (0.70) PTGS2NOTUMALDH1A1GAAKDM4E
SCHEMBL6859504 0.81 PTGS2 (0.41) PTGS2NOTUMALDH1A1GAAKDM4E
SCHEMBL9836026 0.80 PTGS2 (0.50) PTGS2ALDH1A1KDM4ELMNAMEN1
SCHEMBL5070001 0.80 NR1H2 (0.52) PTGS2GAALMNAMAPTHTT
SCHEMBL9834685 0.79 PGR (0.51) ALDH1A1GAAKDM4EMEN1KMT2A
SCHEMBL12725181 0.78 NR1H2 (0.50) PTGS2ALDH1A1MAPTSMN1; SMN2GSK3B
SCHEMBL12725183 0.78 PTGS2 (0.49) PTGS2MEN1KMT2AHPGDMAPT
SCHEMBL16456169 0.78 SENP1 (0.45) PTGS2ALDH1A1GAA
SCHEMBL12391791 0.78 APP (0.40) PTGS2ALDH1A1GAAKDM4ELMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230050869-A1 THERMOELECTRIC CONVERSION MATERIAL, AND THERMOELECTRIC CONVERSION ELEMENT PREPARED THEREWITH TOYO INK SC HOLDINGS CO., LTD. (JP) 2023-02-16 US disclosed
US-20030187106-A1 Red, organge color; photostability, heat resistance MORETTI ROBERT (CH) 2003-10-02 US disclosed
US-6603020-B1 Exhibiting a red or orange fluorescence CIBA SPECIALTY CHEMICALS CORPORATION 2003-08-05 US disclosed
EP-1087005-A1 Fluorescent diketopyrrolopyrroles Ciba SC Holding AG (CH) 2001-03-28 EP disclosed
EP-0133156-B1 1,4-DIKETOPYRROLO-(3,4-C) PYRROLES CIBA-GEIGY AG (CH) 1991-07-10 EP disclosed
US-4666455-A Compositions pigmented with N-substituted 1,4-diketopyrrolo-[3,4-c]-pyrroles CIBA-GEIGY CORPORATION (US) 1987-05-19 US disclosed
US-4585878-A N-substituted 1,4-diketopyrrolo-[3,4-c]-pyrroles CIBA-GEIGY CORPORATION (US) 1986-04-29 US disclosed
EP-0133156-A2 1,4-Diketopyrrolo-(3,4-c) pyrroles CIBA-GEIGY AG (CH) 1985-02-13 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 (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-20030187106-A1 Red, organge color; photostability, heat resistance CBR1, CBR3, DPP8 PTGS2 1776/4885NOTUM 4348/4885ALDH1A1 63/4885

“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.