SCHEMBL22286223

SCHEMBL22286223

Cc1nn(C(C)(C)C)c(N)c1C(=O)O

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
RIPK2 O43353 11/20 0.43
SRC P12931 2/20 0.40
IKBKB O14920 1/20 0.37
IKBKE Q14164 1/20 0.37
POLB P06746 1/20 0.36
ALDH1A1 P00352 1/20 0.36
TSHR P16473 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
KDM4E B2RXH2 1/20 0.36
KMT2A Q03164 1/20 0.36
LCK P06239 1/20 0.36
KDR P35968 1/20 0.36
TGFBR1 P36897 1/20 0.36
MAPK1 P28482 1/20 0.35

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
SCHEMBL18867444 0.85 HPGD (0.44) HPGDSMN1; SMN2RIPK2SRCIKBKB
SCHEMBL4511486 0.85 RIPK2 (0.54) HPGDSMN1; SMN2RIPK2SRCALDH1A1
SCHEMBL9960635 0.81 POLB (0.44) HPGDSMN1; SMN2POLBKDM4EKMT2A
SCHEMBL22286138 0.80 MAPK1 (0.53) HPGDSMN1; SMN2SRCALDH1A1TSHR
SCHEMBL20551750 0.75 KDM4E (0.47) HPGDIKBKBIKBKEPOLBALDH1A1
SCHEMBL6612665 0.73 RIPK2 (0.55) HPGDSMN1; SMN2RIPK2SRCLCK
SCHEMBL18282701 0.71 RIPK2 (0.39) HPGDSMN1; SMN2RIPK2SRCKDM4E
SCHEMBL4172262 0.71 HPGD (0.52) HPGDSMN1; SMN2RIPK2IKBKBIKBKE
SCHEMBL33722 0.71 SMN1; SMN2 (0.52) HPGDSMN1; SMN2RIPK2IKBKBIKBKE
SCHEMBL20551141 0.70 RET (0.40) HPGDIKBKBIKBKEPOLBALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4737449-A1 P53-Y220C SELECTIVE SMALL-MOLECULAR REACTIVATOR COMPOUND, PHARMACEUTICAL COMPOSITION AND USE THEREOF Changchun Genescience Pharmaceutical Co., Ltd. (CN) 2026-05-06 EP disclosed
WO-2025002177-A1 P53-Y220C SELECTIVE SMALL-MOLECULAR REACTIVATOR COMPOUND, PHARMACEUTICAL COMPOSITION AND USE THEREOF 长春金赛药业有限责任公司 2025-01-02 WO disclosed
US-20200247800-A1 SUBSTITUTED BICYCLIC HETEROCYCLIC COMPOUNDS AS NADPH OXIDASE INHIBITORS GLENMARK PHARMACEUTICALS S.A. (CH) 2020-08-06 US disclosed
CN-110914263-A Substituted bicyclic heterocyclic compounds as NADPH oxidase inhibitors 格兰马克药品股份有限公司 2020-03-24 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 (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-20200247800-A1 SUBSTITUTED BICYCLIC HETEROCYCLIC COMPOUNDS AS NADPH OXIDASE INHIBITORS NOX1, CYBB, NOX4 HPGD 16/4885SMN1; SMN2 3077/4885RIPK2 2632/4885

“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.