SCHEMBL24714765

SCHEMBL24714765

Cc1nnc(-c2cc(C(C)(C)C)ncn2)o1

nearest known ligand 0.34

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CA9 Q16790 1/20 0.33
NOTUM Q6P988 2/20 0.31
BRD4 O60885 1/20 0.31
KDM4E B2RXH2 1/20 0.30
NPC1 O15118 1/20 0.30
RAB9A P51151 1/20 0.30
PIM3 Q86V86 1/20 0.30
PIM2 Q9P1W9 1/20 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
SCHEMBL25768459 0.79 BRD4 (0.33) CA12CA1CA2CA9NOTUM
SCHEMBL20166091 0.76 CA12 (0.38) CA12CA1CA2CA9NOTUM
SCHEMBL24714017 0.73 TLR8 (0.33) CA12CA1CA2CA9BRD4
SCHEMBL24920826 0.73 CYP2C19 (0.36) BRD4KDM4ENPC1RAB9APIM3
SCHEMBL278866 0.69 CA2 (0.37) CA2KDM4ENPC1RAB9A
SCHEMBL15051718 0.68 GRM5 (0.41) NPC1RAB9A
SCHEMBL26778349 0.67 CCR1 (0.57) NOTUMBRD4KDM4ENPC1RAB9A
SCHEMBL26766185 0.67 PKM (0.36) NOTUMBRD4KDM4ENPC1RAB9A
SCHEMBL14752242 0.67 KDM4E (0.49) CA2NOTUMBRD4KDM4ENPC1
SCHEMBL24067450 0.66 LMNA (0.34) NPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220235032-A1 BISHETEROCYCLIC CARBONYL SUBSTITUTED DIHYDROPYRAZOLE COMPOUND, PREPARATION METHOD THEREFOR AND PHARMACEUTICAL USE THEREOF GENFLEET THERAPEUTICS (SHANGHAI) INC. (CN) 2022-07-28 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-20220235032-A1 BISHETEROCYCLIC CARBONYL SUBSTITUTED DIHYDROPYRAZOLE COMPOUND, PREPARATION METHOD THEREFOR AND PHARMACEUTICAL USE THEREOF RIPK1, RIPK4, RIPK3 CA12 4187/4885CA1 3093/4885CA2 2255/4885

“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.