SCHEMBL11069061

SCHEMBL11069061

CN(C)C1(c2ccc(Cl)cc2)CCC(N2CCOCC2)CC1

nearest known ligand 0.75

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ OPRL1 P41146 5/20 0.75
▸ ALDH1A1 P00352 2/20 0.43
▸ KDM4E B2RXH2 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ EPHX2 P34913 2/20 0.41
▸ IRAK4 Q9NWZ3 2/20 0.39
▸ KMT2A Q03164 1/20 0.38
▸ RORC P51449 1/20 0.37
▸ MAPT P10636 1/20 0.37
▸ HRH3 Q9Y5N1 1/20 0.37
▸ CRHBP P24387 1/20 0.36
▸ CRHR2 Q13324 1/20 0.36
▸ MCOLN3 Q8TDD5 1/20 0.36
▸ CCR1 P32246 2/20 0.36
▸ CYP11B2 P19099 1/20 0.36

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
Hydrochloric Acid SCHEMBL11073610 0.99 OPRL1 (0.76) OPRL1ALDH1A1KDM4ESMN1; SMN2EPHX2
Hydrochloric Acid SCHEMBL11075754 0.84 OPRL1 (1.00) OPRL1
SCHEMBL11078596 0.76 OPRL1 (0.72) OPRL1IRAK4
SCHEMBL11078979 0.75 OPRL1 (0.45) OPRL1ALDH1A1KMT2AMAPTCCR1
SCHEMBL11069247 0.75 OPRL1 (0.69) OPRL1ALDH1A1KMT2AMAPT
SCHEMBL11075757 0.73 OPRL1 (0.43) OPRL1KMT2ACCR1
SCHEMBL11244959 0.72 SLC6A3 (0.47) OPRL1
SCHEMBL11074296 0.72 OPRL1 (0.42) OPRL1KMT2ACCR1
SCHEMBL11072870 0.72 OPRL1 (0.42) OPRL1KMT2ACCR1
SCHEMBL4352646 0.72 OPRL1 (0.97) OPRL1

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
US-4113866-A ANALGETIC COMPOUNDS, COMPOSITIONS AND PROCESS OF TREATMENT THE UPJOHN COMPANY (US) 1978-09-12 — — US claimed
US-4447454-A Analgetic compounds, compositions and process of treatment THE UPJOHN COMPANY (US) 1984-05-08 — — US disclosed
US-4113866-A ANALGETIC COMPOUNDS, COMPOSITIONS AND PROCESS OF TREATMENT THE UPJOHN COMPANY (US) 1978-09-12 — — US disclosed
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