SCHEMBL24322768

SCHEMBL24322768

c1ccc(N2CCN(CCCNCC3CCCCC3)CC2)cc1

nearest known ligand 0.59

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 1/20 0.55
SLC6A2 P23975 1/20 0.53
SLC6A4 P31645 1/20 0.53
CYP2D6 P10635 1/20 0.51
DRD2 P14416 5/20 0.51
HTR7 P34969 5/20 0.51
DRD4 P21917 3/20 0.51
DRD3 P35462 4/20 0.51
OPRM1 P35372 1/20 0.51
HTR2A P28223 3/20 0.51
HTR2C P28335 3/20 0.51
SIGMAR1 Q99720 1/20 0.50

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
SCHEMBL24324306 0.93 KCNH2 (0.59) KCNH2SLC6A2SLC6A4CYP2D6DRD2
SCHEMBL4775703 0.81 CCR3 (0.59) KCNH2SLC6A2SLC6A4SIGMAR1
SCHEMBL24322696 0.80 DRD2 (0.56) CYP2D6DRD2HTR7DRD4DRD3
SCHEMBL7949267 0.78 SIGMAR1 (0.49) CYP2D6SIGMAR1
SCHEMBL22856216 0.78 SIGMAR1 (0.49) CYP2D6SIGMAR1
SCHEMBL8031282 0.77 GNAI3 (0.46) SIGMAR1
SCHEMBL7375511 0.76 SIGMAR1 (0.65) KCNH2SLC6A2SLC6A4CYP2D6DRD2
SCHEMBL13532848 0.76 HTR7 (0.69) KCNH2DRD2HTR7DRD4DRD3
SCHEMBL8041290 0.76 ALDH1A1 (0.58) CYP2D6
SCHEMBL22848104 0.75 DRD2 (0.58) KCNH2DRD2DRD4DRD3OPRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220122691-A1 HtrA Inhibitors and CagA Inhibitors and Use Thereof Psomagen Inc. (US) 2022-04-21 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-20220122691-A1 HtrA Inhibitors and CagA Inhibitors and Use Thereof HTRA1, GIPR, HPN KCNH2 4773/4885SLC6A2 2464/4885SLC6A4 1143/4885

“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.