SCHEMBL20656815

SCHEMBL20656815

CC(=O)c1ccccc1C1CC1N

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM1A O60341 15/20 0.48
▸ KDM1B Q8NB78 2/20 0.48
▸ KDM4E B2RXH2 1/20 0.42
▸ MAPT P10636 1/20 0.42
▸ HPGD P15428 1/20 0.42
▸ MAOA P21397 11/20 0.41
▸ MAOB P27338 11/20 0.41
▸ CYP2C19 P33261 4/20 0.41
▸ CYP2B6 P20813 3/20 0.41
▸ RCOR1 Q9UKL0 3/20 0.41
▸ CYP1A2 P05177 2/20 0.41
▸ CYP2D6 P10635 2/20 0.41
▸ CYP2C9 P11712 2/20 0.41
▸ LMNA P02545 1/20 0.41
▸ CYP3A4 P08684 1/20 0.41
▸ HTR1A P08908 1/20 0.41
▸ ADRA2A P08913 1/20 0.41
▸ CYP2A6 P11509 1/20 0.41
▸ SLC6A2 P23975 1/20 0.41
▸ HTR2C P28335 1/20 0.41

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
SCHEMBL20656817 1.00 KDM1A (0.48) KDM1AKDM1BKDM4EMAPTHPGD
SCHEMBL1670564 0.83 CYP2C9 (0.51) KDM1AKDM1BKDM4EMAPTHPGD
SCHEMBL13742609 0.80 HTR2C (0.57) MAOBSLC6A2HTR2CSLC6A3
SCHEMBL29932760 0.75 NOTUM (0.42) KDM4ELMNAHTR2CHSD17B10
SCHEMBL16025390 0.75 NOTUM (0.42) KDM4ELMNAHTR2CHSD17B10
SCHEMBL17681983 0.72 CYP2D6 (0.43) HPGDCYP2D6SLC6A2SLC6A3KCNH2
SCHEMBL13442255 0.72 PBRM1 (0.38) KDM4EMAPTHPGDLMNA
SCHEMBL2442839 0.72 PTGDR2 (0.45) MAPTHPGDCYP2D6SLC6A2SLC6A3
SCHEMBL8079290 0.72 HTR2A (0.42) KDM1AHTR2C
SCHEMBL10697894 0.71 TP53 (0.43) KDM4EMAPTHPGDCYP2B6CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-108779096-B Fluorine-substituted cyclopropylamine compounds, and preparation method, pharmaceutical composition and application thereof 中国科学院上海药物研究所 2022-07-01 — — CN disclosed
US-10836743-B2 Fluorinated cyclopropylamine compound, preparation method therefor, pharmaceutical composition thereof, and uses thereof SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES (CN) 2020-11-17 — — US disclosed
US-20190100507-A1 FLUORINATED CYCLOPROPYLAMINE COMPOUND, PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMPOSITION THEREOF, AND USES THEREOF SHANGHAI INSTITUTE OF MATERIA MEDICA, CHINESE ACADEMY OF SCIENCES (CN) 2019-04-04 — — US disclosed
EP-3431471-A1 FLUORINATED CYCLOPROPYLAMINE COMPOUND, PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMPOSITION THEREOF, AND USERS THEREOF Shanghai Institute of Materia Medica, Chinese Academy of Sciences (CN) 2019-01-23 — — EP disclosed
CN-108779096-A A kind of fluorine-substituted cyclopropylamine class compound and preparation method thereof, pharmaceutical composition and purposes 中国科学院上海药物研究所 2018-11-09 — — CN disclosed
CN-107200706-A Cyclopropylamine class compound of one class fluorine substitution and preparation method thereof, pharmaceutical composition and purposes 中国科学院上海药物研究所 2017-09-26 — — CN 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 (2 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-20190100507-A1 FLUORINATED CYCLOPROPYLAMINE COMPOUND, PREPARATION METHOD THEREFOR, PHARMACEUTICAL COMPOSITION THEREOF, AND USES THEREOF SETDB1, KDM1B, SETD7 KDM1A 4/4885KDM1B 2/4885KDM4E 29/4885
US-10836743-B2 Fluorinated cyclopropylamine compound, preparation method therefor, pharmaceutical composition thereof, and uses thereof SETDB1, KDM1B, SETD7 KDM1A 4/4885KDM1B 2/4885KDM4E 29/4885

“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.

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