SCHEMBL20660929

SCHEMBL20660929

Cn1c(=O)n(C)c2cc(C(=N)NO)ccc21

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SMN1; SMN2 Q16637 7/20 0.58
▸ ALDH1A1 P00352 7/20 0.58
▸ HSD17B10 Q99714 2/20 0.58
▸ BRD4 O60885 2/20 0.58
▸ BRPF1 P55201 2/20 0.58
▸ KDM4E B2RXH2 2/20 0.58
▸ GLA P06280 1/20 0.54
▸ MEN1 O00255 1/20 0.54
▸ KMT2A Q03164 1/20 0.54
▸ ATM Q13315 1/20 0.54
▸ HTT P42858 4/20 0.49
▸ TP53 P04637 2/20 0.47
▸ RAB9A P51151 1/20 0.45
▸ MAPT P10636 3/20 0.44
▸ TSHR P16473 1/20 0.44
▸ NR0B1 P51843 1/20 0.44
▸ LMNA P02545 1/20 0.43
▸ GAA P10253 1/20 0.43
▸ XIAP P98170 1/20 0.41
▸ BIRC2 Q13490 1/20 0.41

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
SCHEMBL29040367 0.81 MEN1 (0.67) SMN1; SMN2ALDH1A1HSD17B10BRD4BRPF1
SCHEMBL1422842 0.75 SMN1; SMN2 (0.71) SMN1; SMN2ALDH1A1HSD17B10BRD4BRPF1
SCHEMBL1119999 0.75 SMN1; SMN2 (0.71) SMN1; SMN2ALDH1A1HSD17B10BRD4BRPF1
SCHEMBL20660794 0.75 LMNA (0.46) BRD4MAPTLMNA
SCHEMBL7539164 0.75 SMN1; SMN2 (0.65) SMN1; SMN2ALDH1A1HSD17B10BRD4BRPF1
SCHEMBL23846427 0.74 SMN1; SMN2 (1.00) SMN1; SMN2ALDH1A1HSD17B10BRD4BRPF1
SCHEMBL31060459 0.74 SMN1; SMN2 (1.00) SMN1; SMN2ALDH1A1HSD17B10BRD4BRPF1
SCHEMBL2414207 0.73 MAOB (0.49) KDM4EMEN1KMT2ATP53MAPT
SCHEMBL15415871 0.71 MAOB (0.49) ALDH1A1RAB9AMAPTHPGD
SCHEMBL20660930 0.70 SMN1; SMN2 (0.68) SMN1; SMN2ALDH1A1HSD17B10BRD4BRPF1

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
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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