SCHEMBL22969002

SCHEMBL22969002

CN1C(=O)[C@@H](N)COc2cc(Cl)ncc21

nearest known ligand 0.33

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.33
RIPK1 Q13546 14/20 0.33
GABRG2 P18507 1/20 0.31
GABRB3 P28472 1/20 0.31
GABRA5 P31644 1/20 0.31
LIMK1 P53667 1/20 0.30
LIMK2 P53671 1/20 0.30
BRD4 O60885 2/20 0.30
MAPK7 Q13164 2/20 0.30

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
SCHEMBL22968962 0.85 RIPK1 (0.36) RIPK1GABRG2GABRB3GABRA5
SCHEMBL22968820 0.84 RIPK1 (0.36) RIPK1GABRG2GABRB3GABRA5BRD4
SCHEMBL25767292 0.82 RIPK1 (0.32) RIPK1GABRG2GABRB3GABRA5
SCHEMBL25767068 0.80 IP6K1 (0.37) MAPTRIPK1
SCHEMBL1562222 0.78 AADAT (0.43) RIPK1LIMK1LIMK2
SCHEMBL1562220 0.78 AADAT (0.43) RIPK1LIMK1LIMK2
SCHEMBL25244084 0.76 MEN1 (0.36) MAPTRIPK1LIMK1LIMK2
SCHEMBL25244083 0.76 MEN1 (0.36) MAPTRIPK1LIMK1LIMK2
SCHEMBL18227002 0.76 CYP11B2 (0.48) GABRG2GABRB3GABRA5
SCHEMBL22968883 0.75 ADORA3 (0.39) RIPK1

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-2021029632-A1 FUSED RING HETEROARYL COMPOUNDS AS RIPK1 INHIBITORS BISICHEM CO., LTD. (KR) 2021-02-18 WO disclosed
US-20210040115-A1 FUSED RING HETEROARYL COMPOUNDS AS RIPK1 INHIBITORS BISICHEM CO., LTD. (KR) 2021-02-11 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-20210040115-A1 FUSED RING HETEROARYL COMPOUNDS AS RIPK1 INHIBITORS RIPK1, RIPK3, RIPK4 MAPT 130/4885RIPK1 1/4885GABRG2 4574/4885

“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.