SCHEMBL6436907

SCHEMBL6436907

CCOC(=O)N(c1ccc(N=C=O)cc1)c1ccc(N=C=O)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.41
CYP3A4 P08684 2/20 0.41
CTDSP1 Q9GZU7 1/20 0.38
LMNA P02545 2/20 0.38
MAPT P10636 3/20 0.37
RAB9A P51151 3/20 0.37
NPC1 O15118 2/20 0.37
TRPA1 O75762 1/20 0.37
ALDH1A1 P00352 3/20 0.36
HSD17B10 Q99714 2/20 0.36
POLB P06746 2/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
CYP4Z1 Q86W10 2/20 0.35
PTGIR P43119 3/20 0.34
PTGDR Q13258 1/20 0.34
CYP1A2 P05177 1/20 0.33
CYP2C9 P11712 1/20 0.33
HPGD P15428 1/20 0.33
CYP2C19 P33261 1/20 0.33
KMT2A Q03164 2/20 0.33

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
SCHEMBL76337 0.76 MAPT (0.58) CYP3A4LMNAMAPTRAB9ANPC1
SCHEMBL9228232 0.75 LMNA (0.55) TSHRCYP3A4CTDSP1LMNAMAPT
SCHEMBL11142995 0.75 ALDH1A1 (0.51) TSHRCYP3A4CTDSP1LMNAMAPT
SCHEMBL1363531 0.74 L3MBTL1 (0.55) TSHRCTDSP1LMNAMAPTRAB9A
Ethyl Acetate SCHEMBL28168612 0.74 LMNA (0.47) TSHRCYP3A4LMNAMAPTRAB9A
SCHEMBL3626291 0.74 L3MBTL1 (0.47) TSHRCTDSP1LMNAMAPTRAB9A
SCHEMBL1124189 0.73 CYP4Z1 (0.58) TSHRCYP3A4LMNAMAPTALDH1A1
Hydrochloric Acid SCHEMBL27606948 0.73 L3MBTL1 (0.53) TSHRCTDSP1LMNAMAPTRAB9A
SCHEMBL10815219 0.73 CYP3A4 (0.44) TSHRCYP3A4MAPTRAB9ANPC1
SCHEMBL31147823 0.73 L3MBTL1 (0.53) TSHRCTDSP1LMNAMAPTRAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1196709-B1 METHOD FOR MANUFACTURING A HIGH PERFORMANCE CROSSLINKED THERMOPLASTIC HOSE AND A HIGH PERFORMANCE CROSSLINKED THERMOPLASTIC HOSE PRODUCED THEREBY DAYCO PRODUCTS LLC (US) 2005-04-13 EP claimed
EP-0639597-A1 Process for the preparation of flexible, urethane-group containing foams BAYER AG (DE) 1995-02-22 EP disclosed
EP-0305804-B1 WATER-HARDENING POLYMER COMPOSITION BAYER AG (DE) 1992-09-16 EP disclosed
US-5090405-A Polyether, siloxane, urethane block polymers BAYER AKTIENGESELLSCHAFT (DE) 1992-02-25 US disclosed
EP-0305804-A2 Water-hardening polymer composition BAYER AG (DE) 1989-03-08 EP disclosed
US-4169931-A PROCESS FOR THE PREPARATION OF (THIO)HYDANTOINS SUBSTITUTED WITH AMIDE GROUPS BAYER AKTIENGESELLSCHAFT (DE) 1979-10-02 US disclosed