SCHEMBL25333352

SCHEMBL25333352

Cc1cccc(-n2nc(NC(=O)O)cc2O)n1

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.43
RIPK1 Q13546 1/20 0.41
KDM4E B2RXH2 1/20 0.41
MEN1 O00255 2/20 0.40
KMT2A Q03164 2/20 0.40
NPC1 O15118 1/20 0.40
GBA1 P04062 1/20 0.40
GRM5 P41594 7/20 0.40
SORT1 Q99523 3/20 0.40
IRAK4 Q9NWZ3 1/20 0.39

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
SCHEMBL26352661 0.84 TGFBR1 (0.42) RAB9AMEN1KMT2AGRM5IRAK4
SCHEMBL29425317 0.84 TGFBR1 (0.42) RAB9AMEN1KMT2AGRM5IRAK4
SCHEMBL25336337 0.80 KDM4E (0.52) RAB9AKDM4EMEN1KMT2AIRAK4
SCHEMBL2011053 0.79 MAPT (0.50) RAB9AKDM4ENPC1IRAK4
SCHEMBL2009561 0.75 TGFBR1 (0.51) IRAK4
SCHEMBL29014091 0.73 IRAK4 (0.40) KDM4EMEN1KMT2AIRAK4
SCHEMBL25336136 0.72 TGFBR1 (0.45)
SCHEMBL25335649 0.72 CYP1A2 (0.50) MEN1KMT2A
SCHEMBL26352686 0.72 TGFBR1 (0.42) RAB9ARIPK1MEN1KMT2AIRAK4
SCHEMBL25336656 0.72 IRAK4 (0.39) IRAK4

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-20230303562-A1 PYRAZOLE COMPOUND AND PREPARATION METHOD THEREFOR AND USE THEREOF SICHUAN KELUN-BIOTECH BIOPHARMACEUTICAL CO., LTD. (CN) 2023-09-28 US disclosed
EP-4219453-A1 PYRAZOLE COMPOUND AND PREPARATION METHOD THEREFOR AND USE THEREOF Sichuan Kelun-Biotech Biopharmaceutical Co., Ltd. (CN) 2023-08-02 EP 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-20230303562-A1 PYRAZOLE COMPOUND AND PREPARATION METHOD THEREFOR AND USE THEREOF CYP51A1, CYP4F11, WEE1 RAB9A 3016/4885RIPK1 2827/4885KDM4E 3806/4885

“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.