SCHEMBL18173367

SCHEMBL18173367

[CH2]C1CCN(CCS(=O)(=O)CC)CC1

nearest known ligand 0.35

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HRH1 P35367 3/20 0.35
KCNH2 Q12809 3/20 0.35
GNAI3 P08754 5/20 0.33
GNAO1 P09471 5/20 0.33
GNAI1 P63096 5/20 0.33
ALDH1A1 P00352 2/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
MAPK1 P28482 1/20 0.33
ALOX15 P16050 1/20 0.33
DRD2 P14416 1/20 0.31
SIGMAR1 Q99720 1/20 0.31
GAA P10253 1/20 0.31
KDM1A O60341 1/20 0.30

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
SCHEMBL469147 0.82 CARM1 (0.47) HRH1KCNH2ALDH1A1SIGMAR1
SCHEMBL663338 0.82 ALDH1A1 (0.34) GNAI3GNAO1GNAI1ALDH1A1MAPK1
SCHEMBL441449 0.79 HRH1 (0.34) HRH1KCNH2ALDH1A1SMN1; SMN2MAPK1
SCHEMBL7884661 0.79 KCNH2 (0.34) HRH1KCNH2GNAO1ALDH1A1SMN1; SMN2
SCHEMBL13437776 0.77 SMN1; SMN2 (0.43) HRH1KCNH2GNAI3GNAO1GNAI1
SCHEMBL13437773 0.77 SMN1; SMN2 (0.43) KCNH2GNAI3GNAO1GNAI1ALDH1A1
SCHEMBL8967602 0.75 SMN1; SMN2 (0.43) ALDH1A1SMN1; SMN2MAPK1ALOX15SIGMAR1
SCHEMBL18803169 0.75 PAOX (0.38) SMN1; SMN2SIGMAR1
SCHEMBL13437772 0.75 SMN1; SMN2 (0.36) HRH1KCNH2SMN1; SMN2ALOX15
SCHEMBL8324635 0.74 DRD2 (0.47) GNAI3GNAO1GNAI1DRD2

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
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-A1 LSD1 INHIBITORS AND USES THEREOF Constellation Pharmaceuticals, Inc. (US) 2018-02-28 EP claimed
WO-2016172496-A1 LSD1 INHIBITORS AND USES THEREOF CONSTELLATION PHARMACEUTICALS, INC. (US) 2016-10-27 WO 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 HRH1 1255/4885KCNH2 3023/4885GNAI3 2539/4885

“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.