SCHEMBL23847787

SCHEMBL23847787

CNC(=O)NCc1ccn(C)c1

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 4/20 0.38
▸ ALDH1A1 P00352 3/20 0.38
▸ RAB9A P51151 3/20 0.38
▸ MEN1 O00255 2/20 0.38
▸ KMT2A Q03164 2/20 0.38
▸ HSD17B10 Q99714 1/20 0.38
▸ CYP2D6 P10635 1/20 0.37
▸ OPRD1 P41143 1/20 0.37
▸ OPRK1 P41145 1/20 0.37
▸ NPC1 O15118 3/20 0.37
▸ MTNR1A P48039 1/20 0.36
▸ GLS O94925 2/20 0.35
▸ ACSS2 Q9NR19 1/20 0.34
▸ HPGD P15428 2/20 0.34
▸ EPHX1 P07099 1/20 0.34
▸ TSHR P16473 1/20 0.34
▸ HDAC1 Q13547 1/20 0.34
▸ HDAC6 Q9UBN7 1/20 0.34
▸ TP53 P04637 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
SCHEMBL22253272 0.82 KMT2A (0.49) ALDH1A1RAB9AKMT2AMTNR1AHDAC1
SCHEMBL20666083 0.82 ALDH1A1 (0.43) ALDH1A1MEN1KMT2ATSHR
SCHEMBL20666470 0.78 ERCC1 (0.51) ALDH1A1MEN1KMT2ACYP2D6
SCHEMBL25587391 0.78 HDAC6 (0.50) SMN1; SMN2ALDH1A1OPRK1HDAC1HDAC6
SCHEMBL6047426 0.75 — —
SCHEMBL12880507 0.75 GLS (0.48) MEN1KMT2AGLSHDAC6
Hydrochloric Acid SCHEMBL30831643 0.74 KDM4E (0.46) ALDH1A1GLS
SCHEMBL13853481 0.72 ALDH1A1 (0.61) SMN1; SMN2ALDH1A1MEN1KMT2AHSD17B10
SCHEMBL969258 0.72 SMN1; SMN2 (0.67) SMN1; SMN2ALDH1A1RAB9AMEN1KMT2A
SCHEMBL14543244 0.71 SMN1; SMN2 (0.70) SMN1; SMN2ALDH1A1RAB9AMEN1KMT2A

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
WO-2023212693-A1 ALLOSTERIC CHROMENONE INHIBITORS OF PHOSPHOINOSITIDE 3-KINASE (PI3K) FOR THE TREATMENT OF DISEASE PETRA PHARMA CORPORATION (US) 2023-11-02 — — WO disclosed
US-20210292285-A1 HETEROCYCLIC COMPOUNDS AS ADENOSINE ANTAGONISTS NUVATION BIO INC (US) 2021-09-23 — — 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 (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-20210292285-A1 HETEROCYCLIC COMPOUNDS AS ADENOSINE ANTAGONISTS ADORA2A, ADORA3, ADORA1 SMN1; SMN2 4476/4885ALDH1A1 2100/4885RAB9A 2816/4885

“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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