SCHEMBL20432001

SCHEMBL20432001

CN1c2nc(Br)n(Cc3ccc(Cl)cc3)c2C(=O)NC1O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ POLB P06746 3/20 0.39
▸ TSHR P16473 2/20 0.39
▸ PDE6D O43924 1/20 0.35
▸ PDE5A O76074 1/20 0.35
▸ PDE6A P16499 1/20 0.35
▸ PDE6G P18545 1/20 0.35
▸ PDE4A P27815 1/20 0.35
▸ PDE6B P35913 1/20 0.35
▸ PDE6C P51160 1/20 0.35
▸ PDE4B Q07343 1/20 0.35
▸ PDE4C Q08493 1/20 0.35
▸ PDE4D Q08499 1/20 0.35
▸ PDE6H Q13956 1/20 0.35
▸ PDE11A Q9HCR9 1/20 0.35
▸ PDE10A Q9Y233 1/20 0.35
▸ ATM Q13315 1/20 0.35
▸ APOBEC3G Q9HC16 1/20 0.35
▸ GALR3 O60755 1/20 0.34
▸ NR2F2 P24468 1/20 0.34
▸ RAB9A P51151 1/20 0.34

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
SCHEMBL21316287 0.81 ALDH1A1 (0.35) TSHRATMNOD1MAPTMEN1
SCHEMBL19505598 0.68 NOD1 (0.32) PDE5ALMNANOD1MEN1KMT2A
SCHEMBL22105780 0.67 ALDH1A1 (0.38) LMNAMAPTMEN1KMT2ASMN1; SMN2
SCHEMBL20432346 0.65 P2RX3 (0.35) POLBTSHRP2RX3
SCHEMBL21889017 0.64 LMNA (0.38) POLBTSHRATMAPOBEC3GGALR3
SCHEMBL21499649 0.64 MAPK1 (0.43) POLBTSHRLMNAMAPTMEN1
SCHEMBL16028621 0.63 ATM (0.71) POLBTSHRATMAPOBEC3GLMNA
SCHEMBL16029542 0.62 ALDH1A1 (0.70) POLBTSHRATMRAB9ALMNA
SCHEMBL21332695 0.62 KDM4E (0.42) POLBTSHRPDE4DGALR3NR2F2
SCHEMBL10506664 0.61 PNP (0.60) TYMS

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
EP-2970303-B3 SUBSTITUTED XANTHINES AND METHODS OF USE THEREOF HYDRA BIOSCIENCES INC (US) 2018-08-01 — — EP disclosed
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