SCHEMBL28618587

SCHEMBL28618587

Cc1nn2c(O)c(C(=O)O)cnc2c1-c1c(F)cccc1Cl

nearest known ligand 0.44

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 9/20 0.40
▸ ALDH1A1 P00352 5/20 0.40
▸ KDM4E B2RXH2 3/20 0.40
▸ TSHR P16473 1/20 0.40
▸ LMNA P02545 5/20 0.39
▸ HPGD P15428 2/20 0.39
▸ THRB P10828 2/20 0.39
▸ HAVCR2 Q8TDQ0 1/20 0.38
▸ HSD17B10 Q99714 1/20 0.38
▸ POLB P06746 2/20 0.37
▸ TP53 P04637 1/20 0.37
▸ MEN1 O00255 1/20 0.36
▸ KMT2A Q03164 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 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
SCHEMBL19464235 0.86 MAPT (0.41) MAPTALDH1A1KDM4ETSHRLMNA
SCHEMBL24455511 0.77 MAPT (0.42) MAPTALDH1A1KDM4ETSHRLMNA
SCHEMBL29273417 0.74 NOTUM (0.36) LMNAMEN1KMT2AL3MBTL1
SCHEMBL20722879 0.72 KMT2A (0.37) MAPTALDH1A1KDM4ELMNAPOLB
SCHEMBL23355481 0.70 PIK3C2B (0.42) ALDH1A1KDM4ETSHRLMNAHPGD
SCHEMBL30933431 0.70 PIK3C2B (0.42) ALDH1A1KDM4ETSHRLMNAHPGD
SCHEMBL24770073 0.70 POLQ (0.47) ALDH1A1LMNAHAVCR2MEN1KMT2A
SCHEMBL30017896 0.70 POLQ (0.47) ALDH1A1LMNAHAVCR2MEN1KMT2A
SCHEMBL28630088 0.70 KDM4E (0.43) MAPTALDH1A1KDM4ETSHRLMNA
SCHEMBL20768125 0.70 MAPT (0.41) MAPTALDH1A1KDM4ETSHRLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109071545-B Novel pyrazolopyrimidine derivatives 拜耳动物保健有限责任公司 2021-08-03 — — CN disclosed
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