SCHEMBL27196990

SCHEMBL27196990

O=C(Nc1cc2[nH]c(C(F)(F)F)cc2cn1)C1CCC1

nearest known ligand 0.50

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ ABL1 P00519 17/20 0.50
▸ POLB P06746 1/20 0.44
▸ CDK9 P50750 1/20 0.44
▸ MEN1 O00255 1/20 0.43
▸ TSHR P16473 1/20 0.43
▸ KMT2A Q03164 1/20 0.43

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
SCHEMBL27197253 0.98 ABL1 (0.49) ABL1CDK9
SCHEMBL27197026 0.95 ABL1 (0.50) ABL1
SCHEMBL27196808 0.90 ABL1 (0.48) ABL1
SCHEMBL27197104 0.88 DYRK1A (0.52) ABL1
SCHEMBL29776474 0.88 DYRK1A (0.52) ABL1
SCHEMBL29094420 0.82 NOTUM (0.39) ABL1
SCHEMBL27197049 0.79 PIK3C3 (0.39) MEN1KMT2A
SCHEMBL27196842 0.78 ABL1 (0.42) ABL1
SCHEMBL30595575 0.78 ABL1 (0.42) ABL1
SCHEMBL27196839 0.76 ABL1 (0.52) ABL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240124444-A1 Heterocyclic Compounds and Their Use for Parasitic Diseases CELGENE CORPORATION (US) 2024-04-18 — — US claimed
CN-116685318-A Heterocyclic compounds and their use for parasitic diseases 细胞基因公司 2023-09-01 — — CN claimed
US-20240124444-A1 Heterocyclic Compounds and Their Use for Parasitic Diseases CELGENE CORPORATION (US) 2024-04-18 — — US disclosed
CN-116685318-A Heterocyclic compounds and their use for parasitic diseases 细胞基因公司 2023-09-01 — — 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-20240124444-A1 Heterocyclic Compounds and Their Use for Parasitic Diseases CYP11B2, CYP11B1, CYP8B1 ABL1 1664/4885POLB 2390/4885CDK9 239/4885

“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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