SCHEMBL18614739

SCHEMBL18614739

CC(C)Nc1cnc(-c2ccccc2)c(-c2ccccc2)n1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CKS1B P61024 5/20 0.49
▸ SKP1 P63208 5/20 0.49
▸ SKP2 Q13309 5/20 0.49
▸ MEN1 O00255 2/20 0.47
▸ KMT2A Q03164 2/20 0.47
▸ LMNA P02545 1/20 0.47
▸ SMN1; SMN2 Q16637 1/20 0.47
▸ MAPK10 P53779 1/20 0.45
▸ MAPK14 Q16539 1/20 0.45
▸ TDP1 Q9NUW8 2/20 0.43
▸ MAPT P10636 2/20 0.43
▸ RECQL P46063 1/20 0.43
▸ NPSR1 Q6W5P4 1/20 0.43
▸ L3MBTL1 Q9Y468 1/20 0.43
▸ CNR1 P21554 3/20 0.42
▸ ABL1 P00519 1/20 0.41
▸ LCK P06239 1/20 0.41
▸ CSF1R P07333 1/20 0.41
▸ PDGFRB P09619 1/20 0.41
▸ MAP2K2 P36507 1/20 0.41

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
SCHEMBL5211084 0.80 CKS1B (0.53) CKS1BSKP1SKP2MEN1KMT2A
SCHEMBL5214272 0.76 CKS1B (0.49) CKS1BSKP1SKP2CNR1HCAR3
SCHEMBL24046599 0.73 CKS1B (0.53) CKS1BSKP1SKP2MEN1KMT2A
SCHEMBL12890450 0.73 PDGFRB (0.55) LMNASMN1; SMN2MAPK10MAPK14NPSR1
SCHEMBL28700972 0.71 CYP1A2 (0.50) CKS1BSKP1SKP2MEN1KMT2A
SCHEMBL19823495 0.71 CKS1B (0.46) CKS1BSKP1SKP2MAPK14MAPT
SCHEMBL30725768 0.71 CYP1A2 (0.50) CKS1BSKP1SKP2MEN1KMT2A
SCHEMBL31498236 0.70 SMN1; SMN2 (0.61) MEN1KMT2ALMNASMN1; SMN2NPSR1
SCHEMBL29678556 0.70 ADORA2A (0.64) CKS1BSKP1SKP2MEN1KMT2A
SCHEMBL2684042 0.70 CKS1B (0.58) CKS1BSKP1SKP2MEN1KMT2A

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
US-20240216366-A1 PHARMACEUTICAL COMPOSITION COMPRISING A DIPHENYLPYRAZINE DERIVATIVE ACTELION PHARMACEUTICALS LTD (CH) 2024-07-04 — — US disclosed
US-20240091223-A1 PHARMACEUTICAL COMPOSITION COMPRISING A DIPHENYLPYRAZINE DERIVATIVE ACTELION PHARMACEUTICALS LTD (CH) 2024-03-21 — — US disclosed
WO-2024017964-A1 INJECTABLE PHARMACEUTICAL COMPOSITION COMPRISING A DIPHENYLPYRAZINE DERIVATIVE ACTELION PHARMACEUTICALS LTD (CH) 2024-01-25 — — WO disclosed
EP-4284334-A1 PHARMACEUTICAL COMPOSITION COMPRISING A DIPHENYLPYRAZINE DERIVATIVE Actelion Pharmaceuticals Ltd (CH) 2023-12-06 — — EP disclosed
CN-116744903-A Pharmaceutical composition comprising diphenylpyrazine derivatives 埃科特莱茵药品有限公司 2023-09-12 — — CN disclosed
US-10544107-B2 Process for the preparation of 2-{4-[(5,6-diphenyl pyrazin-2-yl)(isopropyl)amino]butoxy}-N-(methylsulfonyl)acetamide and novel polymorphs thereof MAITHRI DRUGS PRIVATE LIMITED (IN) 2020-01-28 — — US disclosed
US-20190152927-A1 NOVEL PROCESS FOR THE PREPARATION OF 2-{4-[(5,6-DIPHENYL PYRAZIN-2-YL)(ISOPROPYL)AMINO]BUTOXY}-N-(METHYLSULFONYL)ACETAMIDE AND NOVEL POLYMORPHS THEREOF MAITHRI DRUGS PRIVATE LIMITED (IN) 2019-05-23 — — US disclosed
WO-2017042828-A2 PROCESS FOR THE PREPARATION OF SELEXIPAG AND INTERMEDIATES THEREOF MEGAFINE PHARMA (P) LTD. (IN) 2017-03-16 — — WO disclosed
WO-2017042828-A2 PROCESS FOR THE PREPARATION OF SELEXIPAG AND INTERMEDIATES THEREOF MEGAFINE PHARMA (P) LTD. (IN) 2017-03-16 — — 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 (4 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-20190152927-A1 NOVEL PROCESS FOR THE PREPARATION OF 2-{4-[(5,6-DIPHENYL PYRAZIN-2-YL)(ISOPROPYL)AMINO]BUTOXY}-N-(METHYLSULFONYL)ACETAMIDE AND NOVEL POLYMORPHS THEREOF PKD1, PKD2, CYP2S1 CKS1B 234/4885SKP1 60/4885SKP2 313/4885
US-20240091223-A1 PHARMACEUTICAL COMPOSITION COMPRISING A DIPHENYLPYRAZINE DERIVATIVE IL5, CACNA1C, IAPP CKS1B 4684/4885SKP1 2713/4885SKP2 3081/4885
US-10544107-B2 Process for the preparation of 2-{4-[(5,6-diphenyl pyrazin-2-yl)(isopropyl)amino]butoxy}-N-(methylsulfonyl)acetamide and novel polymorphs thereof CYP2E1, CYP2S1, CYP1B1 CKS1B 338/4885SKP1 33/4885SKP2 266/4885
US-20240216366-A1 PHARMACEUTICAL COMPOSITION COMPRISING A DIPHENYLPYRAZINE DERIVATIVE IL5, CACNA1C, IAPP CKS1B 4684/4885SKP1 2713/4885SKP2 3081/4885

“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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