SCHEMBL27496008

SCHEMBL27496008

CN1CC[C@]23c4c5ccc(OC(=O)c6cccnc6)c4O[C@H]2[C@@H](O)C=C[C@H]3[C@H]1C5

nearest known ligand 0.66

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ OPRD1 P41143 7/20 0.66
▸ OPRM1 P35372 6/20 0.66
▸ OPRK1 P41145 4/20 0.66
▸ MRGPRX2 Q96LB1 4/20 0.66
▸ ADRB1 P08588 1/20 0.66
▸ PDE4D Q08499 1/20 0.66
▸ PDE3A Q14432 1/20 0.66
▸ SLC22A1 O15245 1/20 0.59
▸ ADRA2A P08913 1/20 0.59
▸ ARRB1 P49407 1/20 0.59

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
Nicomorphine SCHEMBL680036 0.91 OPRD1 (0.69) OPRD1OPRM1OPRK1MRGPRX2ADRB1
Nicomorphine SCHEMBL29349768 0.91 OPRD1 (0.69) OPRD1OPRM1OPRK1MRGPRX2ADRB1
Nicomorphine SCHEMBL26237 0.91 OPRD1 (0.69) OPRD1OPRM1OPRK1MRGPRX2ADRB1
Nicomorphine SCHEMBL29408441 0.91 OPRD1 (0.69) OPRD1OPRM1OPRK1MRGPRX2ADRB1
SCHEMBL15501040 0.90 OPRD1 (0.73) OPRD1OPRM1OPRK1MRGPRX2ADRB1
SCHEMBL6459794 0.90 OPRD1 (0.77) OPRD1OPRM1OPRK1MRGPRX2ADRB1
SCHEMBL12082085 0.90 OPRD1 (0.73) OPRD1OPRM1OPRK1MRGPRX2ADRB1
Nicomorphine SCHEMBL395672 0.90 OPRD1 (0.68) OPRD1OPRM1OPRK1MRGPRX2ADRB1
Nicomorphine SCHEMBL1649977 0.90 OPRD1 (0.68) OPRD1OPRM1OPRK1MRGPRX2ADRB1
SCHEMBL12082084 0.89 OPRD1 (0.76) OPRD1OPRM1OPRK1MRGPRX2ADRB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-120058608-A Pentazocine prodrug for long-acting injection, preparation method and application 安徽益普克医药科技发展有限公司 2025-05-30 — — CN disclosed
CN-111447927-A Naloxone transdermal drug delivery device and method of use thereof 帝国制药美国公司 2020-07-24 — — CN disclosed
CN-110831575-A Pharmaceutical preparation 卡里亚制药控股有限公司 2020-02-21 — — CN disclosed
CN-110658337-A Diagnosis and treatment of autoimmune diseases 戴埃克斯有限公司 2020-01-07 — — CN disclosed
CN-110612103-A Pharmaceutical composition comprising meloxicam 艾克萨姆治疗公司 2019-12-24 — — CN disclosed
CN-100393713-C Therapeutic agents useful for treating pain EURO CELTIQUE SA (LU) 2008-06-11 — — CN disclosed
CN-1190438-C Nabufulin polybasic ester derivative and its production method HU YOUPU (CN) 2005-02-23 — — CN disclosed
CN-1354740-A Pharmaceutical compounds NICOX SA (FR) 2002-06-19 — — CN disclosed
CN-1321643-A Nabufulin polybasic ester derivative and its production method HU YOUPU (CN) 2001-11-14 — — CN disclosed
Send feedback