SCHEMBL23530866

SCHEMBL23530866

CCc1cnn2c(OC(=O)NCc3cn4c(C)cccc4n3)cc(Cl)nc12

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ KLKB1 P03952 5/20 0.40
▸ RAB9A P51151 6/20 0.39
▸ GAA P10253 3/20 0.39
▸ MAPK1 P28482 2/20 0.38
▸ MAPT P10636 5/20 0.37
▸ SMN1; SMN2 Q16637 4/20 0.37
▸ NPC1 O15118 2/20 0.37
▸ MEN1 O00255 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ TP53 P04637 1/20 0.37
▸ KDM4E B2RXH2 3/20 0.35
▸ POLB P06746 1/20 0.35
▸ LMNA P02545 1/20 0.34
▸ RECQL P46063 1/20 0.34
▸ BLM P54132 1/20 0.34
▸ TDP1 Q9NUW8 1/20 0.34
▸ ALDH1A1 P00352 1/20 0.33

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
SCHEMBL23530859 0.88 PDE10A (0.34) KLKB1GAAMAPK1MAPTSMN1; SMN2
SCHEMBL23530871 0.86 RAB9A (0.39) KLKB1RAB9AGAAMAPK1MAPT
SCHEMBL23530794 0.83 RAB9A (0.48) KLKB1RAB9AGAAMAPTSMN1; SMN2
SCHEMBL23530758 0.81 HSD17B10 (0.47) RAB9AMAPK1MAPTSMN1; SMN2NPC1
SCHEMBL20838999 0.78 ALDH1A1 (0.46) RAB9AGAAMAPK1MEN1KMT2A
SCHEMBL23531003 0.77 KLKB1 (0.40) KLKB1MAPTKDM4EPOLBALDH1A1
SCHEMBL23530864 0.76 RAB9A (0.39) KLKB1RAB9AGAAMAPK1MAPT
SCHEMBL20838997 0.76 ROCK2 (0.40) KLKB1MAPK1
SCHEMBL23530583 0.76 KLKB1 (0.43) KLKB1
SCHEMBL23530958 0.75 KLKB1 (0.35) KLKB1RAB9ANPC1

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-20230144197-A1 4-[[(7-AMINOPYRAZOLO[1,5-A]PYRIMIDIN-5-YL)AMINO]METHYL]PIPERIDIN-3-OL COMPOUNDS AND THEIR THERAPEUTIC USE Carrick Therapeutics Limited (IE) 2023-05-11 — — US disclosed
WO-2021122745-A1 4-[[(7-AMINOPYRAZOLO[1,5-A]PYRIMIDIN-5-YL)AMINO]METHYL]PIPERIDIN-3-OL COMPOUNDS AND THEIR THERAPEUTIC USE Carrick Therapeutics Limited (IE) 2021-06-24 — — WO 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-20230144197-A1 4-[[(7-AMINOPYRAZOLO[1,5-A]PYRIMIDIN-5-YL)AMINO]METHYL]PIPERIDIN-3-OL COMPOUNDS AND THEIR THERAPEUTIC USE CDK1, CDK3, CDK2 KLKB1 2395/4885RAB9A 2672/4885GAA 2363/4885

“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