SCHEMBL8736182

SCHEMBL8736182

CCCCCCCCc1ccc(N2C(=O)C=CC2=O)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MGLL Q99685 6/20 1.00
▸ FAAH O00519 3/20 1.00
▸ ESR1 P03372 2/20 0.50
▸ ADRA2A P08913 2/20 0.50
▸ ADORA3 P0DMS8 2/20 0.50
▸ TACR2 P21452 2/20 0.50
▸ SLC6A2 P23975 2/20 0.50
▸ SLC6A4 P31645 2/20 0.50
▸ SLC6A3 Q01959 2/20 0.50
▸ HSD17B10 Q99714 2/20 0.50
▸ ALDH1A1 P00352 2/20 0.50
▸ KDM4E B2RXH2 1/20 0.50
▸ LMNA P02545 1/20 0.50
▸ SHBG P04278 1/20 0.50
▸ TP53 P04637 1/20 0.50
▸ CYP3A4 P08684 1/20 0.50
▸ HSPD1 P10809 1/20 0.50
▸ ADRB3 P13945 1/20 0.50
▸ HTR2C P28335 1/20 0.50
▸ HSPE1 P61604 1/20 0.50

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
SCHEMBL3395815 1.00 MGLL (1.00) MGLLFAAHESR1ADRA2AADORA3
SCHEMBL3482538 0.98 MGLL (0.97) MGLLFAAHESR1ADRA2AADORA3
SCHEMBL1087192 0.93 MGLL (0.87) MGLLFAAHHSD17B10ALDH1A1
SCHEMBL8402814 0.91 MGLL (0.83) MGLLFAAHESR1ADRA2AADORA3
SCHEMBL28264790 0.91 MGLL (0.83) MGLLFAAHALDH1A1LMNA
SCHEMBL8852774 0.89 MGLL (0.80) MGLLFAAHALDH1A1LMNA
SCHEMBL3482746 0.85 MGLL (1.00) MGLLFAAHALDH1A1LMNA
SCHEMBL27951835 0.85 MGLL (0.73) MGLLFAAHALDH1A1LMNA
SCHEMBL22862122 0.84 MGLL (0.72) MGLLFAAHHSD17B10ALDH1A1
SCHEMBL27174528 0.84 MGLL (0.72) MGLLFAAHALDH1A1LMNAS1PR1

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-0722959-B1 Highly oxygen-permeable heat-resistant material MENICON CO LTD (JP) 1998-04-08 — — EP disclosed
US-5587445-A Highly oxygen-permeable heat-resistant material MENICON CO., LTD. (JP) 1996-12-24 — — US disclosed
EP-0722959-A2 Highly oxygen-permeable heat-resistant material Menicon Co., Ltd. (JP) 1996-07-24 — — EP disclosed
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