SCHEMBL100360

SCHEMBL100360

OC(c1ccccc1)(c1ccccc1)[C@H]1CCCN1

nearest known ligand 0.96

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2D6 P10635 2/20 0.96
MAPK1 P28482 2/20 0.96
KDM4E B2RXH2 1/20 0.96
NPC1 O15118 1/20 0.96
CYP1A2 P05177 1/20 0.96
HPGD P15428 1/20 0.96
CYP2C19 P33261 1/20 0.96
RAB9A P51151 1/20 0.96
LMNA P02545 3/20 0.53
MEN1 O00255 1/20 0.53
HRH1 P35367 1/20 0.53
SCN1A P35498 1/20 0.53
KMT2A Q03164 1/20 0.53
SCN2A Q99250 1/20 0.53
SCN3A Q9NY46 1/20 0.53
ATM Q13315 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
CHRM3 P20309 1/20 0.40
KEAP1 Q14145 1/20 0.40
NFE2L2 Q16236 1/20 0.40

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
SCHEMBL100361 1.00 CYP2D6 (0.96) CYP2D6MAPK1KDM4ENPC1CYP1A2
SCHEMBL239738 1.00 CYP2D6 (0.96) CYP2D6MAPK1KDM4ENPC1CYP1A2
SCHEMBL8136171 0.98 CYP2D6 (0.93) CYP2D6MAPK1KDM4ENPC1CYP1A2
SCHEMBL7446968 0.98 CYP2D6 (0.93) CYP2D6MAPK1KDM4ENPC1CYP1A2
Hydrochloric Acid SCHEMBL9277459 0.98 CYP2D6 (1.00) CYP2D6MAPK1KDM4ENPC1CYP1A2
Pipradrol SCHEMBL156360 0.95 CYP2D6 (0.87) CYP2D6MAPK1KDM4ENPC1CYP1A2
Pipradrol SCHEMBL4057811 0.93 CYP2D6 (0.90) CYP2D6MAPK1KDM4ENPC1CYP1A2
Sulfuric Acid SCHEMBL9452303 0.92 CYP2D6 (0.82) CYP2D6MAPK1KDM4ENPC1CYP1A2
SCHEMBL6295242 0.90 CYP2D6 (0.79) CYP2D6MAPK1KDM4ENPC1CYP1A2
SCHEMBL5054811 0.90 CYP2D6 (0.79) CYP2D6MAPK1KDM4ENPC1CYP1A2

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 434 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3995492-B1 A TWO-STEP PROCESS FOR PREPARING 3-SUBSTITUTED PHENYLALKYLAMINES SpecGx LLC (US) 2024-05-29 EP claimed
US-11993608-B2 Selective estrogen receptor degraders ELI LILLY AND COMPANY (US) 2024-05-28 US claimed
US-20230234960-A1 SELECTIVE ESTROGEN RECEPTOR DEGRADERS ELI LILLY AND COMPANY 2023-07-27 US claimed
CN-115260206-A Estrogen receptor degradation agent, intermediate thereof, preparation method, pharmaceutical composition and application 明慧医药(杭州)有限公司 2022-11-01 CN claimed
EP-3995492-A1 A TWO-STEP PROCESS FOR PREPARING 3-SUBSTITUTED PHENYLALKYLAMINES SpecGx LLC (US) 2022-05-11 EP claimed
CN-107652274-B Pentaerythritol immobilized (S) or (R) -diphenyl prolinol, and preparation method and application thereof 石家庄学院 2020-07-21 CN claimed
CN-105884625-B Synthetic method of R-salmeterol 浙江工业大学 2018-11-13 CN claimed
CN-104829468-B (R)The asymmetric preparation method of albuterol hydrochloride 成都先基生化科技有限公司 2017-03-08 CN claimed
CN-105884625-A synthetic method of R-salmeterol 浙江工业大学 2016-08-24 CN claimed
CN-104326959-B A kind of preparation method of Ezetimibe isomers WUHAN WUYAO TECHNOLOGY CO., LTD. (CN) 2016-05-25 CN claimed
US-20130030210-A1 METHODS FOR PREPARING AMIDES AND AMINO ACIDS WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2013-01-31 US claimed
US-8269039-B2 Amino acids and catalytic preparatory methods WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2012-09-18 US claimed
CN-102584795-A Preparing method of crizotinib HONG TANG 2012-07-18 CN claimed
US-20090264676-A1 Amino acids and catalytic preparatory methods WARF - WISCONSIN ALUMNI RESEARCH FOUNDATION (US) 2009-10-22 US claimed
US-20080176923-A1 Proline Derivatives Used as Pharmaceutical Active Ingredients for the Treatment of Tumors SALAMA ZOSER B 2008-07-24 US claimed
EP-0873298-A4 CHIRAL REDUCTIONS OF IMINES LEADING TO THE SYNTHESES OF OPTICALLY ACTIVE AMINES NPS PHARMA INC (US) 2000-05-17 EP claimed
US-5925666-A DOPAMINE UPTAKE INHIBITORS; DRUG ABUSE AND DEPENDENCE, EATING DISORDERS, ATTENTION DEFICIT DISORDER, TOURETTE*S SYNDROME, GAMBLING GUILFORD PHARMACEUTICALS INC. (US) 1999-07-20 US claimed
WO-1999003467-A1 PHARMACEUTICAL COMPOSITIONS AND METHODS FOR TREATING COMPULSIVE DISORDERS USING PYRROLIDINE DERIVATIVES GUILFORD PHARMACEUTICALS INC. (US) 1999-01-28 WO claimed
EP-0873298-A1 CHIRAL REDUCTIONS OF IMINES LEADING TO THE SYNTHESES OF OPTICALLY ACTIVE AMINES NPS PHARMACEUTICALS, INC. (US) 1998-10-28 EP claimed
WO-1997011934-A1 CHIRAL REDUCTIONS OF IMINES LEADING TO THE SYNTHESES OF OPTICALLY ACTIVE AMINES NPS PHARMACEUTICALS, INC. (US) 1997-04-03 WO claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (5 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20130030210-A1 METHODS FOR PREPARING AMIDES AND AMINO ACIDS DNPEP, PTMS, QPCT CYP2D6 1973/4885MAPK1 4782/4885KDM4E 2890/4885
US-20230234960-A1 SELECTIVE ESTROGEN RECEPTOR DEGRADERS ESR1, GPER1, ESR2 CYP2D6 154/4885MAPK1 3369/4885KDM4E 1011/4885
US-11993608-B2 Selective estrogen receptor degraders ESR1, GPER1, ESR2 CYP2D6 154/4885MAPK1 3369/4885KDM4E 1011/4885
US-20090264676-A1 Amino acids and catalytic preparatory methods DNPEP, PREP, ENPEP CYP2D6 2032/4885MAPK1 4540/4885KDM4E 2582/4885
US-20080176923-A1 Proline Derivatives Used as Pharmaceutical Active Ingredients for the Treatment of Tumors PREP, PRAP1, VHL CYP2D6 3249/4885MAPK1 4093/4885KDM4E 1762/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.