SCHEMBL5597553

SCHEMBL5597553

N#Cc1ccc(NC(=O)Nc2cc(C3CC3)n[nH]2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.51
LMNA P02545 3/20 0.51
TSHR P16473 1/20 0.51
HTT P42858 1/20 0.51
NLRP3 Q96P20 1/20 0.51
EPHX1 P07099 1/20 0.48
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 0.48
ALDH1A1 P00352 2/20 0.48
LRRK2 Q5S007 1/20 0.47
SAE1 Q9UBE0 1/20 0.47
UBA2 Q9UBT2 1/20 0.47
KDM4E B2RXH2 1/20 0.47
POLB P06746 1/20 0.47
PKM P14618 1/20 0.47
MAPK1 P28482 1/20 0.47
RAB9A P51151 1/20 0.47
IL18 Q14116 1/20 0.47
CA12 O43570 2/20 0.44
CA1 P00915 2/20 0.44

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
SCHEMBL5597685 0.85 MAOA (0.44) MAPTHTTEPHX1MEN1KMT2A
SCHEMBL5867611 0.84 LRRK2 (0.56) MEN1KMT2AALDH1A1LRRK2PKM
SCHEMBL5597709 0.84 RAB9A (0.50) MAPTLMNAEPHX1MEN1KMT2A
SCHEMBL5597942 0.83 TP53 (0.47) MAPTLMNATSHRHTTEPHX1
SCHEMBL5597539 0.80 KMT2A (0.55) MEN1KMT2ARAB9ACA12CA1
SCHEMBL5868164 0.78 LRRK2 (0.51) MAPTLMNAMEN1KMT2AALDH1A1
SCHEMBL4122716 0.78 MAPT (0.46) MAPTLMNAHTTMEN1KMT2A
SCHEMBL5597454 0.78 ALDH1A1 (0.52) MAPTLMNAHTTEPHX1MEN1
SCHEMBL5597880 0.78 RXFP1 (0.44) MAPTMEN1KMT2AALDH1A1RAB9A
SCHEMBL5597734 0.77 ALDH1A1 (0.41) TSHRHTTMEN1KMT2AALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1202734-B1 3(5)-UREIDO-PYRAZOLE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS ANTITUMOR AGENTS PFIZER ITALIA SRL (IT) 2007-05-02 EP claimed
EP-1202734-A4 3(5)-UREIDO-PYRAZOLE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS ANTITUMOR AGENTS PHARMACIA ITALIA SPA (IT) 2004-09-01 EP claimed
JP-2003507328-A 2003-02-25 JP claimed
US-6387900-B1 ANTICANCER AGENTS PHARMACIA & UPJOHN S.P.A. (IT) 2002-05-14 US claimed
EP-1202734-A1 3(5)-UREIDO-PYRAZOLE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS ANTITUMOR AGENTS Pharmacia Italia S.p.A. (IT) 2002-05-08 EP claimed
WO-2001012188-A1 3(5)-UREIDO-PYRAZOLE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS ANTITUMOR AGENTS PHARMACIA & UPJOHN S.P.A. (IT) 2001-02-22 WO claimed
EP-1202734-B1 3(5)-UREIDO-PYRAZOLE DERIVATIVES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS ANTITUMOR AGENTS PFIZER ITALIA SRL (IT) 2007-05-02 EP disclosed
US-6387900-B1 ANTICANCER AGENTS PHARMACIA & UPJOHN S.P.A. (IT) 2002-05-14 US disclosed