SCHEMBL19966681

SCHEMBL19966681

CCC(C)(C)N1CCCN(c2ncccn2)CC1

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ HRH3 Q9Y5N1 4/20 0.43
▸ LMNA P02545 4/20 0.42
▸ MAPT P10636 2/20 0.42
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ HSD17B10 Q99714 1/20 0.41
▸ KDM4E B2RXH2 3/20 0.40
▸ SLC6A7 Q99884 1/20 0.40
▸ USP2 O75604 1/20 0.40
▸ POLB P06746 1/20 0.40
▸ KMT2A Q03164 2/20 0.40
▸ MEN1 O00255 1/20 0.40
▸ TDP1 Q9NUW8 1/20 0.40
▸ RAB9A P51151 1/20 0.40
▸ ALDH1A1 P00352 1/20 0.40
▸ MDM2 Q00987 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
SCHEMBL19440754 0.93 LMNA (0.47) HRH3LMNAMAPTSMN1; SMN2HSD17B10
SCHEMBL14192112 0.85 LMNA (0.46) HRH3LMNAMAPTSMN1; SMN2HSD17B10
SCHEMBL8261413 0.77 LMNA (0.52) HRH3LMNAMAPTSMN1; SMN2HSD17B10
SCHEMBL2168776 0.76 KDM4E (0.60) LMNAMAPTSMN1; SMN2HSD17B10KDM4E
SCHEMBL14218699 0.75 MEN1 (0.49) SMN1; SMN2KDM4EPOLBKMT2AMEN1
SCHEMBL18893549 0.74 KDM4E (0.59) HRH3MAPTSMN1; SMN2HSD17B10KDM4E
Ammonia Solution, Strong SCHEMBL28080150 0.74 KDM4E (0.58) LMNAMAPTSMN1; SMN2HSD17B10KDM4E
Water SCHEMBL28082091 0.74 KDM4E (0.58) LMNAMAPTSMN1; SMN2HSD17B10KDM4E
SCHEMBL18059326 0.74 — —
SCHEMBL11955036 0.74 CYP2D6 (0.49) SMN1; SMN2HSD17B10USP2KMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10227340-B2 Thiazolyl- or thiadiazolyl-substituted pyridyl compounds useful as kinase inhibitors BRISTOL-MYERS SQUIBB COMPANY (US) 2019-03-12 — — US disclosed
US-20180072712-A1 THIAZOLYL- OR THIADIAZOLYL-SUBSTITUTED PYRIDYL COMPOUNDS USEFUL AS KINASE INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2018-03-15 — — 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-20180072712-A1 THIAZOLYL- OR THIADIAZOLYL-SUBSTITUTED PYRIDYL COMPOUNDS USEFUL AS KINASE INHIBITORS IRAK4, IRAK1, IRAK3 HRH3 2555/4885LMNA 1458/4885MAPT 2007/4885
US-10227340-B2 Thiazolyl- or thiadiazolyl-substituted pyridyl compounds useful as kinase inhibitors IRAK4, IRAK1, IRAK3 HRH3 2555/4885LMNA 1458/4885MAPT 2007/4885

“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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