SCHEMBL20527306

SCHEMBL20527306

[CH2]C1CCN(CCC(C)(C)C(=O)O)CC1

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KCNA3 P22001 3/20 0.38
ARG1 P05089 3/20 0.37
ARG2 P78540 3/20 0.37
POLB P06746 1/20 0.36
HTT P42858 1/20 0.36
CACNA1I Q9P0X4 4/20 0.34
KCNH2 Q12809 3/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
ACLY P53396 1/20 0.33
OPRM1 P35372 1/20 0.33
ACACB O00763 1/20 0.33
ACACA Q13085 1/20 0.33

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
SCHEMBL27911982 0.80 ARG1 (0.45) ARG1ARG2POLBKCNH2OPRM1
SCHEMBL7327831 0.78 PAOX (0.43) ACLYACACBACACA
Hydrochloric Acid SCHEMBL11725592 0.77 ARG1 (0.46) ARG1ARG2POLBKCNH2MEN1
Hydrochloric Acid SCHEMBL27945156 0.75 SIGMAR1 (0.46) POLBMEN1KMT2A
SCHEMBL15434608 0.75 SMN1; SMN2 (0.56) ARG1ARG2MEN1KMT2AOPRM1
Hydrochloric Acid SCHEMBL27945162 0.75 SIGMAR1 (0.46) POLBMEN1KMT2A
SCHEMBL20527341 0.72 GLA (0.52) POLBHTT
SCHEMBL1515165 0.70 HTR2B (0.34) KCNA3
SCHEMBL18173152 0.69 KDM4E (0.37)
SCHEMBL12155298 0.69 CACNA1I (0.48) CACNA1IKCNH2OPRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3286172-B1 LSD1 INHIBITORS AND USES THEREOF CONSTELLATION PHARMACEUTICALS INC (US) 2019-06-12 EP claimed
US-20180290976-A1 LSD1 INHIBITORS AND USES THEREOF CONSTELLATION PHARMACEUTICALS, INC. 2018-10-11 US claimed
EP-3286172-B1 LSD1 INHIBITORS AND USES THEREOF CONSTELLATION PHARMACEUTICALS INC (US) 2019-06-12 EP disclosed
US-20180290976-A1 LSD1 INHIBITORS AND USES THEREOF CONSTELLATION PHARMACEUTICALS, INC. 2018-10-11 US 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-20180290976-A1 LSD1 INHIBITORS AND USES THEREOF KDM1B, KDM1A, KDM2A KCNA3 2746/4885ARG1 180/4885ARG2 119/4885

“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.