SCHEMBL3019759

SCHEMBL3019759

COc1ccc(CN(c2ccccc2)c2cc(CN3CCC(NCc4ccccc4)CC3)nn3ccnc23)cc1

nearest known ligand 0.55

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 3/20 0.55
▸ KMT2A Q03164 3/20 0.55
▸ ACHE P22303 11/20 0.44
▸ BACE1 P56817 10/20 0.44
▸ BCHE P06276 7/20 0.44
▸ MCHR1 Q99705 1/20 0.41
▸ SIGMAR1 Q99720 3/20 0.41
▸ CCR3 P51677 1/20 0.40
▸ POLB P06746 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39

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
SCHEMBL3022229 0.85 CLPP (0.38) MEN1KMT2AACHESIGMAR1
SCHEMBL3014592 0.80 CYP19A1 (0.37) MEN1KMT2ASIGMAR1ALDH1A1
SCHEMBL3010219 0.77 CYP19A1 (0.39) MEN1KMT2ASIGMAR1ALDH1A1
SCHEMBL3022050 0.74 CYP19A1 (0.37) MEN1KMT2ASIGMAR1ALDH1A1
SCHEMBL16515936 0.73 CYP19A1 (0.42) MEN1KMT2AACHESIGMAR1ALDH1A1
SCHEMBL3023355 0.67 CYP11B1 (0.36) MEN1KMT2ASMN1; SMN2
SCHEMBL3023245 0.67 CYP11B1 (0.43) SMN1; SMN2
SCHEMBL3023816 0.67 CYP19A1 (0.35) ACHEALDH1A1SMN1; SMN2
SCHEMBL3012557 0.67 EGFR (0.35) ACHEBCHEALDH1A1SMN1; SMN2
SCHEMBL7219006 0.64 MEN1 (0.75) MEN1KMT2AACHEBACE1BCHE

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-20100204212-A1 FUSED HETEROCYCLIC COMPOUNDS USEFUL AS KINASE MODULATORS BRISTOL-MYERS SQUIBB COMPANY 2010-08-12 — — US disclosed
US-7723336-B2 Fused heterocyclic compounds useful as kinase modulators BRISTOL-MYERS SQUIBB COMPANY (US) 2010-05-25 — — US disclosed
US-20080045536-A1 FUSED HETEROCYCLIC COMPOUNDS USEFUL AS KINASE MODULATORS BRISTOL-MYERS SQUIBB COMPANY 2008-02-21 — — 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 (2 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-20100204212-A1 FUSED HETEROCYCLIC COMPOUNDS USEFUL AS KINASE MODULATORS MAP2K2, MAP3K2, MAP4K2 MEN1 1665/4885KMT2A 584/4885ACHE 3761/4885
US-20080045536-A1 FUSED HETEROCYCLIC COMPOUNDS USEFUL AS KINASE MODULATORS MAP3K3, MAP3K2, MAP4K3 MEN1 1632/4885KMT2A 726/4885ACHE 3779/4885

“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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