SCHEMBL3650360

SCHEMBL3650360

CC(C)NC(=O)c1cccc(N)c1

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 2/20 0.59
ALOX5 P09917 1/20 0.54
KDM4C Q9H3R0 1/20 0.54
KDM4E B2RXH2 1/20 0.54
ALDH1A1 P00352 1/20 0.54
ADRB2 P07550 1/20 0.52
ADRB1 P08588 1/20 0.52
ADRB3 P13945 1/20 0.52
HSD17B10 Q99714 2/20 0.51
SMN1; SMN2 Q16637 1/20 0.51
ERN1 O75460 2/20 0.50
PBRM1 Q86U86 1/20 0.50
PTGS1 P23219 1/20 0.48
NPC1 O15118 1/20 0.47
MITF O75030 1/20 0.47
LMNA P02545 1/20 0.47
POLB P06746 1/20 0.47
ROCK2 O75116 1/20 0.47
CYP3A4 P08684 1/20 0.47
CYP3A5 P20815 1/20 0.47

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
SCHEMBL8536043 0.88 ALDH1A1 (0.53) NPSR1KDM4CKDM4EALDH1A1ADRB2
SCHEMBL8545999 0.87 ALDH1A1 (0.49) NPSR1ALOX5KDM4CKDM4EALDH1A1
SCHEMBL8593124 0.87 NPSR1 (0.69) NPSR1KDM4EALDH1A1HSD17B10SMN1; SMN2
SCHEMBL22100076 0.86 ALDH1A1 (0.51) NPSR1KDM4CKDM4EALDH1A1ADRB2
SCHEMBL13753417 0.86 ALDH1A1 (0.51) NPSR1KDM4CKDM4EALDH1A1ADRB2
SCHEMBL31530474 0.85 KDM4C (0.48) NPSR1KDM4CKDM4EALDH1A1ADRB2
SCHEMBL9576672 0.85 CA2 (0.51) NPSR1KDM4CKDM4EALDH1A1HSD17B10
SCHEMBL9576671 0.85 CA2 (0.51) NPSR1KDM4CKDM4EALDH1A1HSD17B10
SCHEMBL3652880 0.83 MAP4K4 (0.53) NPSR1KDM4CKDM4EALDH1A1ADRB2
SCHEMBL18176014 0.83 ALDH1A1 (0.59) NPSR1KDM4CKDM4EALDH1A1HSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2188289-A2 (7H-PYRROLO[2,3-D]PYRIMIDIN-4-YL)-PIPERAZINES AS KINASE INHIBITORS FOR THE TREATMENT OF CANCER AND INFLAMMATION Lexicon Pharmaceuticals, Inc. (US) 2010-05-26 EP claimed
WO-2009021169-A2 (7H-PYRR0L0 [2, 3-D] PYRIMIDIN-4-YL) -PIPERAZINES AS KINASE INHIBITORS FOR THE TREATMENT OF CANCER AND INFLAMMATION LEXICON PHARMACEUTICALS, INC. (US) 2009-02-12 WO claimed
US-20230045031-A1 Diarylamide Compound and Application Thereof SUNSHINE LAKE PHARMA CO., LTD. (CN) 2023-02-09 US disclosed
US-20220151962-A1 NOVEL INHIBITORS OF HISTONE DEACETYLASE 10 DEUTSCHES KREBSFORSCHUNGSZENTRUM (DE) 2022-05-19 US disclosed
EP-3984534-A1 DIARYLAMIDE COMPOUND AND APPLICATION THEREOF Peking University (CN) 2022-04-20 EP disclosed
WO-2020253802-A1 DIARYLAMIDE COMPOUND AND APPLICATION THEREOF 北京大学 2020-12-24 WO disclosed
US-20190292189-A1 LIM KINASE INHIBITORS VIRONGY, LLC 2019-09-26 US disclosed
WO-2017201187-A1 LIM KINASE INHIBITORS VIRONGY, LLC (US) 2017-11-23 WO disclosed
CN-107226785-A Adamantane styrenic derivatives and its preparation method and application 长春工业大学 2017-10-03 CN disclosed
US-20170239259-A1 ARYLOXY PHENOXY ACRYLIC COMPOUND HAVING HIF-1 INHIBITION ACTIVITY, METHOD FOR PREPARING SAME, AND PHARMACEUTICAL COMPOSITION CONTAINING SAME AS AN ACTIVE INGREDIENT KOREA RESEARCH INSTITUTE OF BIOSCIENCE AND BIOTECHNOLOGY (KR) 2017-08-24 US disclosed
EP-2188289-B1 (7H-PYRROLO[2,3-D]PYRIMIDIN-4-YL)-PIPERAZINES AS KINASE INHIBITORS FOR THE TREATMENT OF CANCER AND INFLAMMATION LEXICON PHARMACEUTICALS INC (US) 2015-10-28 EP disclosed
EP-2188289-A2 (7H-PYRROLO[2,3-D]PYRIMIDIN-4-YL)-PIPERAZINES AS KINASE INHIBITORS FOR THE TREATMENT OF CANCER AND INFLAMMATION Lexicon Pharmaceuticals, Inc. (US) 2010-05-26 EP disclosed
CN-101565420-A LIMK2 inhibitors, compositions comprising them, and methods of their use LEXICON PHARMACEUTICALS INC (US) 2009-10-28 CN disclosed
US-20090264450-A1 LIMK2 INHIBITORS, COMPOSITIONS COMPRISING THEM, AND METHODS OF THEIR USE OXFORD FINANCE LLC, AS COLLATERAL AGENT 2009-10-22 US disclosed
US-7576117-B1 Cyclic amine CCR3 antagonist TEIJIN LIMITED (JP) 2009-08-18 US disclosed
US-7576117-B1 Cyclic amine CCR3 antagonist TEIJIN LIMITED (JP) 2009-08-18 US disclosed
WO-2009021169-A2 (7H-PYRR0L0 [2, 3-D] PYRIMIDIN-4-YL) -PIPERAZINES AS KINASE INHIBITORS FOR THE TREATMENT OF CANCER AND INFLAMMATION LEXICON PHARMACEUTICALS, INC. (US) 2009-02-12 WO disclosed
US-20090042893-A1 KINASE INHIBITORS, COMPOSITIONS COMPRISING THEM, AND METHODS OF THEIR USE OXFORD FINANCE LLC, AS COLLATERAL AGENT 2009-02-12 US disclosed
CN-1137879-C Process for preparing 3-aminobenzoylamine 中国人民解放军军事医学科学院放射医 2004-02-11 CN disclosed
CN-1382686-A Process for preparing 3-aminobenzoylamine INST OF RADIOMEDICINE P L A AC (CN) 2002-12-04 CN 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 (6 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-20090042893-A1 KINASE INHIBITORS, COMPOSITIONS COMPRISING THEM, AND METHODS OF THEIR USE LIMK2, LIMK1, TNK2 NPSR1 4433/4885ALOX5 3339/4885KDM4C 2089/4885
US-20220151962-A1 NOVEL INHIBITORS OF HISTONE DEACETYLASE 10 HDAC10, HDAC1, HDAC11 NPSR1 4626/4885ALOX5 3291/4885KDM4C 398/4885
US-20090264450-A1 LIMK2 INHIBITORS, COMPOSITIONS COMPRISING THEM, AND METHODS OF THEIR USE LIMK2, LIMK1, LIMA1 NPSR1 4143/4885ALOX5 3027/4885KDM4C 3222/4885
US-20170239259-A1 ARYLOXY PHENOXY ACRYLIC COMPOUND HAVING HIF-1 INHIBITION ACTIVITY, METHOD FOR PREPARING SAME, AND PHARMACEUTICAL COMPOSITION CONTAINING SAME AS AN ACTIVE INGREDIENT HIF1A, HIF1AN, VHL NPSR1 3209/4885ALOX5 910/4885KDM4C 827/4885
US-20230045031-A1 Diarylamide Compound and Application Thereof SLC14A1, SLC28A1, SLC28A2 NPSR1 1718/4885ALOX5 4736/4885KDM4C 3721/4885
US-20190292189-A1 LIM KINASE INHIBITORS LIMK1, LIMK2, LIMA1 NPSR1 4409/4885ALOX5 4433/4885KDM4C 4302/4885

“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.