SCHEMBL6982504

SCHEMBL6982504

COCO[C@H]1CCN([C@@H](CO)c2ccc(C)cc2)C1

nearest known ligand 0.34

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ HRH3 Q9Y5N1 2/20 0.34
▸ MAPT P10636 2/20 0.33
▸ CCR3 P51677 2/20 0.32
▸ MCHR1 Q99705 1/20 0.32
▸ HCN1 O60741 1/20 0.32
▸ HCN4 Q9Y3Q4 1/20 0.32
▸ TP53 P04637 1/20 0.32
▸ GBA1 P04062 1/20 0.32
▸ RORC P51449 1/20 0.32
▸ KDM4E B2RXH2 1/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ KMT2A Q03164 1/20 0.32
▸ SCN1A P35498 1/20 0.32
▸ SCN2A Q99250 1/20 0.32
▸ SCN3A Q9NY46 1/20 0.32
▸ POLB P06746 1/20 0.31
▸ HSD11B1 P28845 1/20 0.31

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
SCHEMBL8475345 1.00 HRH3 (0.34) HRH3MAPTCCR3MCHR1HCN1
SCHEMBL6982502 1.00 HRH3 (0.34) HRH3MAPTCCR3MCHR1HCN1
SCHEMBL6974169 0.89 OPRL1 (0.42) HRH3MCHR1KDM4EKMT2APOLB
SCHEMBL6979034 0.89 OPRL1 (0.42) HRH3MCHR1KDM4EKMT2APOLB
SCHEMBL7872456 0.89 OPRL1 (0.42) HRH3MCHR1KDM4EKMT2APOLB
SCHEMBL6974165 0.89 OPRL1 (0.42) HRH3MCHR1KDM4EKMT2APOLB
SCHEMBL8508323 0.89 OPRL1 (0.42) HRH3MCHR1KDM4EKMT2APOLB
SCHEMBL8473770 0.86 SLC6A9 (0.36) MCHR1GBA1
SCHEMBL6981689 0.86 SLC6A9 (0.36) MCHR1GBA1
SCHEMBL6981686 0.86 SLC6A9 (0.36) MCHR1GBA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0817772-B1 PYRROLIDINYL HYDROXAMIC ACID COMPOUNDS AND THEIR PRODUCTION PROCESS PFIZER (US) 2003-01-29 — — EP disclosed
US-6110947-A AN ANALGESIC AGENT FOR TREATING STROKE, ABDOMINAL PAIN; AS ANTIINFLAMMATORY, DIURETIC, ANESTHETIC OR NEUROPROTECTIVE AGENTS PFIZER INC. (US) 2000-08-29 — — US disclosed
US-5952369-A ANALGESIC, TREATMENT FOR STROKE OR ABDOMINAL PAIN ASSOCIATED WITH FUNCTIONAL BOWEL DISEASE PFIZER INC (US) 1999-09-14 — — US disclosed
WO-1996030339-A1 PYRROLIDINYL HYDROXAMIC ACID COMPOUNDS AND THEIR PRODUCTION PROCESS PFIZER INC. (US) 1996-10-03 — — WO disclosed
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