SCHEMBL22617005

SCHEMBL22617005

OCC1(CCCc2ccccc2)CCNCC1

nearest known ligand 0.57

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 2/20 0.55
OPRL1 P41146 1/20 0.55
MEN1 O00255 4/20 0.54
KMT2A Q03164 4/20 0.54
KDM4E B2RXH2 1/20 0.54
ALDH1A1 P00352 5/20 0.49
SIGMAR1 Q99720 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.48
PKM P14618 1/20 0.46
NPC1 O15118 1/20 0.43
LMNA P02545 1/20 0.43
MAPT P10636 1/20 0.43
TACR1 P25103 1/20 0.43
GAA P10253 1/20 0.43
OPRD1 P41143 1/20 0.43

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 SCHEMBL22616948 0.98 OPRM1 (0.53) OPRM1OPRL1MEN1KMT2AKDM4E
SCHEMBL27694964 0.90 ALDH1A1 (0.52) OPRM1OPRL1MEN1KMT2AKDM4E
SCHEMBL4905758 0.85 OPRM1 (0.58) OPRM1OPRL1MEN1KMT2AKDM4E
SCHEMBL4909810 0.85 OPRM1 (0.58) OPRM1OPRL1MEN1KMT2AKDM4E
SCHEMBL22616949 0.82 MEN1 (0.47) OPRM1OPRL1MEN1KMT2AKDM4E
SCHEMBL5175182 0.80 OPRM1 (0.56) OPRM1OPRL1MEN1KMT2AALDH1A1
SCHEMBL1220833 0.80 GAA (0.48) OPRM1MEN1KMT2AKDM4EALDH1A1
Hydrochloric Acid SCHEMBL7984412 0.79 OPRM1 (0.55) OPRM1OPRL1MEN1KMT2AALDH1A1
Hydrochloric Acid SCHEMBL28686967 0.78 GAA (0.47) OPRM1MEN1KMT2AKDM4EALDH1A1
SCHEMBL5881047 0.77 OPRM1 (0.54) OPRM1OPRL1MEN1KMT2AKDM4E

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-20220213055-A1 SUBSTITUTED (PIPERIDIN-1-YL)ARYL ANALOGUES FOR MODULATING AVIL ACTIVITY UNIV VIRGINIA PATENT FOUNDATION (US) 2022-07-07 US disclosed
US-20220213055-A1 SUBSTITUTED (PIPERIDIN-1-YL)ARYL ANALOGUES FOR MODULATING AVIL ACTIVITY UNIV VIRGINIA PATENT FOUNDATION (US) 2022-07-07 US disclosed
EP-3962485-A1 SUBSTITUTED (PIPERIDIN-1-YL)ARYL ANALOGUES FOR MODULATING AVILACTIVITY University Of Virginia Patent Foundation (US) 2022-03-09 EP disclosed
WO-2020223715-A1 SUBSTITUTED (PIPERIDIN-1-YL)ARYL ANALOGUES FOR MODULATING AVILACTIVITY UNIVERSITY OF VIRGINIA PATENT FOUNDATION (US) 2020-11-05 WO disclosed
WO-2020223715-A1 SUBSTITUTED (PIPERIDIN-1-YL)ARYL ANALOGUES FOR MODULATING AVILACTIVITY UNIVERSITY OF VIRGINIA PATENT FOUNDATION (US) 2020-11-05 WO 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 (1 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-20220213055-A1 SUBSTITUTED (PIPERIDIN-1-YL)ARYL ANALOGUES FOR MODULATING AVIL ACTIVITY VCL, VPS28, HDLBP OPRM1 2542/4885OPRL1 824/4885MEN1 1765/4885

“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.