SCHEMBL5483394

SCHEMBL5483394

N#CC1(c2cccc(F)c2)CCNCC1

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.40
KMT2A Q03164 1/20 0.40
KDM1A O60341 2/20 0.40
OPRM1 P35372 1/20 0.38
USP2 O75604 2/20 0.37
CYP2D6 P10635 2/20 0.37
BDKRB1 P46663 1/20 0.37
ALOX15 P16050 1/20 0.37
SLC6A4 P31645 4/20 0.37
SLC6A3 Q01959 4/20 0.37
SLC6A2 P23975 3/20 0.37
CYP2C19 P33261 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
SCHEMBL10526309 0.88 KDM1A (0.46) ALDH1A1KMT2AKDM1AOPRM1BDKRB1
SCHEMBL1018956 0.85 SLC6A4 (0.46) ALDH1A1KMT2AKDM1AOPRM1BDKRB1
SCHEMBL626449 0.85 KDM1A (0.43) ALDH1A1KMT2AKDM1AOPRM1BDKRB1
SCHEMBL1020648 0.83 SLC6A4 (0.49) ALDH1A1KMT2AKDM1ABDKRB1SLC6A4
SCHEMBL12369418 0.83 OPRM1 (0.32) OPRM1
SCHEMBL10253721 0.82 ALDH1A1 (0.40) ALDH1A1KMT2AKDM1AOPRM1BDKRB1
Bromide SCHEMBL2270664 0.81 OPRM1 (0.32) OPRM1
SCHEMBL625294 0.81 ICMT (0.44) ALDH1A1KMT2AKDM1AOPRM1BDKRB1
SCHEMBL5726355 0.81 KMT2A (0.40) KMT2AOPRM1CYP2D6SLC6A4SLC6A3
SCHEMBL4442862 0.81 KMT2A (0.40) KMT2AOPRM1SLC6A4SLC6A3SLC6A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12459921-B2 Isoindoline compound, preparation method, pharmaceutical composition and use thereof SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES (CN) 2025-11-04 US disclosed
CN-114085212-B Isoindoline compound, preparation method, pharmaceutical composition and application thereof 中国科学院上海药物研究所 2023-05-02 CN disclosed
US-20220041576-A1 ISOINDOLINE COMPOUND, PREPARATION METHOD, PHARMACEUTICAL COMPOSITION AND USE THEREOF SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES (CN) 2022-02-10 US disclosed
US-20070078120-A1 Novel piperidine derivative DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2007-04-05 US disclosed
EP-1679069-A1 NOVEL PIPERIDINE DERIVATIVE Dainippon Sumitomo Pharma Co., Ltd. (JP) 2006-07-12 EP disclosed

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

For each of this compound's patents that has machine-readable text (3 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-20070078120-A1 Novel piperidine derivative LDLR, PRMT5, MSR1 ALDH1A1 2990/4885KMT2A 1301/4885KDM1A 716/4885
US-12459921-B2 Isoindoline compound, preparation method, pharmaceutical composition and use thereof CUL4B, CUL4A, UBQLN1 ALDH1A1 825/4885KMT2A 878/4885KDM1A 787/4885
US-20220041576-A1 ISOINDOLINE COMPOUND, PREPARATION METHOD, PHARMACEUTICAL COMPOSITION AND USE THEREOF CUL4B, CUL4A, UBQLN1 ALDH1A1 825/4885KMT2A 878/4885KDM1A 787/4885

“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.