SCHEMBL26610869

SCHEMBL26610869

C[C@@H](N)c1cccc(C(F)(F)CCC2CCN(C(=O)O)CC2)c1F

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ DPP4 P27487 8/20 0.39
▸ DPP7 Q9UHL4 7/20 0.39
▸ SOS1 Q07889 1/20 0.38
▸ GPR119 Q8TDV5 1/20 0.37
▸ CCR5 P51681 2/20 0.37
▸ CYP2C9 P11712 1/20 0.36
▸ CYP2C19 P33261 1/20 0.36
▸ HTR2B P41595 1/20 0.36
▸ MAPK14 Q16539 1/20 0.36
▸ NPC1 O15118 1/20 0.35
▸ OPRK1 P41145 1/20 0.35
▸ TACR1 P25103 1/20 0.35
▸ DPP9 Q86TI2 1/20 0.34
▸ SMYD3 Q9H7B4 1/20 0.34

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
SCHEMBL26610870 1.00 DPP4 (0.39) DPP4DPP7SOS1GPR119CCR5
SCHEMBL26611127 0.90 DPP4 (0.39) DPP4DPP7SOS1GPR119CYP2C9
SCHEMBL26611131 0.90 DPP4 (0.39) DPP4DPP7SOS1GPR119CYP2C9
SCHEMBL26695795 0.87 DPP4 (0.46) DPP4GPR119
SCHEMBL30631057 0.87 DPP4 (0.46) DPP4GPR119
SCHEMBL26611084 0.81 DPP4 (0.36) DPP4DPP7SOS1TACR1DPP9
SCHEMBL26611081 0.81 DPP4 (0.36) DPP4DPP7SOS1TACR1DPP9
SCHEMBL25094741 0.80 NAMPT (0.39) DPP4GPR119TACR1
SCHEMBL30631081 0.78 GPR119 (0.44) DPP4GPR119NPC1
SCHEMBL26695713 0.78 GPR119 (0.44) DPP4GPR119NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240208975-A1 MACROCYCLIC HETEROCYCLES AND USES THEREOF KUMQUAT BIOSCIENCES INC. 2024-06-27 — — US disclosed
US-11912708-B2 Macrocyclic heterocycles and uses thereof KUMQUAT BIOSCIENCES INC. (US) 2024-02-27 — — US disclosed
US-20230339952-A1 MACROCYCLIC HETEROCYCLES AND USES THEREOF KUMQUAT BIOSCIENCES INC. 2023-10-26 — — 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 (3 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-20240208975-A1 MACROCYCLIC HETEROCYCLES AND USES THEREOF HRAS, KRAS, TP53 DPP4 3640/4885DPP7 2703/4885SOS1 349/4885
US-11912708-B2 Macrocyclic heterocycles and uses thereof HRAS, KRAS, TP53 DPP4 3640/4885DPP7 2703/4885SOS1 349/4885
US-20230339952-A1 MACROCYCLIC HETEROCYCLES AND USES THEREOF HRAS, KRAS, TP53 DPP4 3640/4885DPP7 2703/4885SOS1 349/4885

“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.

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