SCHEMBL25589670

SCHEMBL25589670

COc1cc(-c2cnn(C3CCN(C(=O)OC(C)(C)C)CC3)c2)ccc1N

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TTK P33981 2/20 0.59
▸ TNK2 Q07912 1/20 0.50
▸ MET P08581 5/20 0.49
▸ LIPC P11150 1/20 0.49
▸ GPR119 Q8TDV5 3/20 0.48
▸ FGFR1 P11362 2/20 0.48
▸ FGFR2 P21802 2/20 0.48
▸ FGFR4 P22455 2/20 0.48
▸ FGFR3 P22607 2/20 0.48
▸ KDR P35968 2/20 0.48
▸ FLT3 P36888 2/20 0.48
▸ RET P07949 1/20 0.46
▸ DDB1 Q16531 1/20 0.46
▸ CRBN Q96SW2 1/20 0.46
▸ CCNC P24863 1/20 0.46
▸ CDK8 P49336 1/20 0.46
▸ CTSD P07339 1/20 0.44
▸ CTSE P14091 1/20 0.44
▸ BACE1 P56817 1/20 0.44
▸ RIPK2 O43353 1/20 0.44

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
SCHEMBL17402370 0.85 GPR119 (0.57) TTKTNK2METLIPCGPR119
SCHEMBL2750453 0.82 TNK2 (0.55) TTKTNK2METLIPCGPR119
SCHEMBL20135336 0.81 GPR119 (0.58) TTKTNK2METLIPCGPR119
SCHEMBL25515656 0.81 CCNC (0.51) TTKTNK2METGPR119FGFR1
SCHEMBL10040511 0.81 GPR119 (0.57) TTKTNK2METLIPCGPR119
SCHEMBL15416477 0.81 DDB1 (0.53) TTKTNK2METLIPCGPR119
SCHEMBL1653749 0.80 TNK2 (0.56) TNK2METGPR119FGFR1FGFR2
SCHEMBL28806344 0.80 MET (0.53) TTKTNK2METLIPCGPR119
SCHEMBL29434952 0.80 RET (0.53) TTKTNK2METFGFR1FGFR2
SCHEMBL21526495 0.79 ALDH1A1 (0.54) TTKTNK2METLIPCGPR119

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-20230183243-A1 HETEROARYL DERIVATIVES AND PHARMACEUTICAL COMPOSITION COMPRISING SAME AS ACTIVE INGREDIENT VORONOIBIO INC. (KR) 2023-06-15 — — US disclosed
US-20230183243-A1 HETEROARYL DERIVATIVES AND PHARMACEUTICAL COMPOSITION COMPRISING SAME AS ACTIVE INGREDIENT VORONOIBIO INC. (KR) 2023-06-15 — — US disclosed
CN-113574057-A Heteroaryl derivatives and pharmaceutical compositions containing the same as active ingredient 株式会社沃若诺伊 2021-10-29 — — 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-20230183243-A1 HETEROARYL DERIVATIVES AND PHARMACEUTICAL COMPOSITION COMPRISING SAME AS ACTIVE INGREDIENT TTK, TTBK1, TTBK2 TTK 1/4885TNK2 10/4885MET 777/4885

“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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