SCHEMBL23344488

SCHEMBL23344488

Cc1nc2nccnc2cc1NC(=O)CN(C)C

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PIK3CA P42336 1/20 0.36
▸ TP53 P04637 3/20 0.36
▸ MAPT P10636 2/20 0.36
▸ JAK1 P23458 1/20 0.36
▸ ABL1 P00519 1/20 0.35
▸ CCNA2 P20248 1/20 0.35
▸ CDK2 P24941 1/20 0.35
▸ CDK9 P50750 1/20 0.35
▸ CCNA1 P78396 1/20 0.35
▸ KDM4E B2RXH2 1/20 0.34
▸ HPGD P15428 1/20 0.34
▸ CTRB1 P17538 1/20 0.34
▸ PARP1 P09874 2/20 0.34
▸ TUBB4A P04350 1/20 0.34
▸ TUBB P07437 1/20 0.34
▸ TUBA3C P0DPH7 1/20 0.34
▸ TUBA1B P68363 1/20 0.34
▸ TUBA4A P68366 1/20 0.34
▸ TUBB4B P68371 1/20 0.34
▸ TUBB3 Q13509 1/20 0.34

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
SCHEMBL23344506 0.76 PIK3CA (0.49) PIK3CACCNA2CDK2CDK9CCNA1
SCHEMBL23344487 0.75 MEN1 (0.51) KDM4EHTTSMN1; SMN2MEN1KMT2A
SCHEMBL23344468 0.73 NPC1 (0.56) MAPTKDM4EHPGDHTTSMN1; SMN2
SCHEMBL23344477 0.73 MEN1 (0.53) PIK3CATP53MAPTHPGDMEN1
SCHEMBL23344489 0.72 PIK3CA (0.65) PIK3CATP53MAPTCDK9KDM4E
SCHEMBL23344442 0.71 MEN1 (0.48) MAPTABL1KDM4EHPGDLMNA
SCHEMBL23344440 0.69 SMN1; SMN2 (0.56) TP53MAPTKDM4EHPGDLMNA
SCHEMBL23344469 0.68 HTT (0.53) MAPTKDM4EHPGDLMNAGAA
SCHEMBL23344502 0.67 NPC1 (0.45) MAPTKDM4ELMNAGAASMN1; SMN2
SCHEMBL7546481 0.65 HPGD (0.62) MAPTHPGDLMNASMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11117894-B2 Pyridopyrazine compounds and uses thereof CITY OF HOPE (US) 2021-09-14 — — US disclosed
US-20210139476-A1 PYRIDOPYRAZINE COMPOUNDS AND USES THEREOF NATIONAL AND KAPODISTRIAN UNIVERSITY OF ATHENS (GR) 2021-05-13 — — 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 (2 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-11117894-B2 Pyridopyrazine compounds and uses thereof PDXK, DPYD, PNPO PIK3CA 1262/4885TP53 1220/4885MAPT 2937/4885
US-20210139476-A1 PYRIDOPYRAZINE COMPOUNDS AND USES THEREOF PDXK, DPYD, PNPO PIK3CA 1262/4885TP53 1220/4885MAPT 2937/4885

“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.

Send feedback