SCHEMBL20660796

SCHEMBL20660796

Cn1c(=O)[nH]c2ccc(C(N)=NO)cc21

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ LMNA P02545 1/20 0.46
▸ PGR P06401 2/20 0.45
▸ MAOB P27338 3/20 0.40
▸ B3GNT2 Q9NY97 3/20 0.40
▸ BRD4 O60885 3/20 0.39
▸ DAO P14920 3/20 0.39
▸ KDM4E B2RXH2 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ BRPF1 P55201 1/20 0.39
▸ SMN1; SMN2 Q16637 1/20 0.39
▸ HSD17B10 Q99714 1/20 0.39
▸ RECQL P46063 1/20 0.38
▸ AURKA O14965 2/20 0.36
▸ TYMP P19971 2/20 0.36

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
SCHEMBL20116661 1.00 LMNA (0.46) LMNAPGRMAOBB3GNT2BRD4
SCHEMBL6763764 0.83 BRD4 (0.57) LMNAPGRMAOBB3GNT2BRD4
SCHEMBL21156818 0.78 LMNA (0.51) LMNAPGRMAOBB3GNT2DAO
SCHEMBL1759132 0.78 B3GNT2 (0.61) LMNAPGRMAOBB3GNT2DAO
SCHEMBL25195141 0.77 LMNA (0.50) LMNAPGRMAOBB3GNT2BRD4
SCHEMBL20660930 0.75 SMN1; SMN2 (0.68) LMNABRD4KDM4EALDH1A1BRPF1
SCHEMBL20116594 0.75 SMN1; SMN2 (0.68) LMNABRD4KDM4EALDH1A1BRPF1
SCHEMBL6763505 0.75 AURKA (0.56) LMNAPGRMAOBB3GNT2AURKA
SCHEMBL1759187 0.75 CREBBP (0.51) LMNAPGRMAOBB3GNT2BRD4
SCHEMBL12673423 0.75 B3GNT2 (0.49) LMNAPGRMAOBB3GNT2BRD4

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
CN-117777121-A Compounds and uses thereof 詹森药业有限公司 2024-03-29 — — CN disclosed
CN-110099898-B Compounds and uses thereof 优曼尼蒂治疗公司 2023-07-25 — — CN disclosed
EP-3700934-A1 COMPOUNDS AND USES THEREOF Yumanity Therapeutics, Inc. (US) 2020-09-02 — — EP disclosed
WO-2019209948-A9 COMPOUNDS AND USES THEREOF YUMANITY THERAPEUTICS, INC. (US) 2020-01-02 — — WO disclosed
WO-2019018795-A1 COMPOUNDS AND USES THEREOF YUMANITY THERAPEUTICS (US) 2019-01-24 — — WO disclosed
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