SCHEMBL6179731

SCHEMBL6179731

CC(C)(C)OC(=O)N1CCN(C(=O)c2ccnc(Cl)c2)CC1

nearest known ligand 0.61

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 2/20 0.61
▸ KMT2A Q03164 2/20 0.61
▸ POLB P06746 1/20 0.60
▸ CFTR P13569 2/20 0.47
▸ HDAC4 P56524 1/20 0.47
▸ RAB9A P51151 1/20 0.47
▸ CRBN Q96SW2 1/20 0.47
▸ SMYD3 Q9H7B4 1/20 0.47
▸ PROKR1 Q8TCW9 1/20 0.46
▸ LMNA P02545 1/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ HSD17B10 Q99714 1/20 0.46
▸ GPR119 Q8TDV5 2/20 0.46
▸ CNR2 P34972 1/20 0.46
▸ SCD5 Q86SK9 1/20 0.46
▸ EPHX2 P34913 1/20 0.45
▸ GFER P55789 1/20 0.45
▸ STS P08842 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
SCHEMBL6178837 0.84 MEN1 (0.54) MEN1KMT2APOLBCFTRHDAC4
SCHEMBL3294559 0.84 MEN1 (0.54) MEN1KMT2APOLBCFTRHDAC4
SCHEMBL1432796 0.83 POLB (0.53) MEN1KMT2APOLBLMNASMN1; SMN2
SCHEMBL7496576 0.82 SMN1; SMN2 (0.49) MEN1KMT2APOLBRAB9ASMYD3
SCHEMBL20768985 0.82 SMYD3 (0.70) MEN1KMT2APOLBCFTRHDAC4
SCHEMBL2928633 0.82 RAB9A (0.70) MEN1KMT2APOLBHDAC4RAB9A
SCHEMBL2671554 0.82 MEN1 (0.54) MEN1KMT2APOLBCFTRHDAC4
SCHEMBL30324594 0.81 USP30 (0.43) MEN1KMT2APOLBPROKR1GPR119
SCHEMBL2377432 0.81 POLB (0.59) MEN1KMT2APOLBCFTRGPR119
SCHEMBL3960220 0.80 MEN1 (0.66) MEN1KMT2APOLBHDAC4LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1218376-B1 TYROSINE KINASE INHIBITORS MERCK & CO INC (US) 2005-11-09 — — EP disclosed
US-6586424-B2 Anticancer agents; anticholesterol agents MERCK & CO., INC. 2003-07-01 — — US disclosed
US-6586423-B2 2-(Pyridin-2-ylamino)-thiazole-5-carbonitrile derivatives; angiogenesis inhibitors; antitumor and anticarcinogenic agents; atherosclerosis, macular degeneration, diabetic retinopathy MERCK & CO., INC. 2003-07-01 — — US disclosed
US-20030064996-A1 Tyrosine kinase inhibitors MERCK SHARP & DOHME CORP. 2003-04-03 — — US disclosed
US-20020147203-A1 Tyrosine kinase inhibitors MERCK & CO., INC. 2002-10-10 — — 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-20020147203-A1 Tyrosine kinase inhibitors ERBB2, TYRO3, TIE1 MEN1 4406/4885KMT2A 3298/4885POLB 2548/4885
US-20030064996-A1 Tyrosine kinase inhibitors ERBB2, TYRO3, TIE1 MEN1 4406/4885KMT2A 3298/4885POLB 2548/4885

“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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