SCHEMBL22629445

SCHEMBL22629445

CC1CC2(CCN(CCC3CCCCC3)CC2)C1

nearest known ligand 0.43

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 7/20 0.43
ACHE P22303 1/20 0.41
CYP1A2 P05177 2/20 0.39
L3MBTL1 Q9Y468 1/20 0.35
CYP2D6 P10635 1/20 0.34
ALOX15 P16050 1/20 0.34

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
SCHEMBL17828184 0.78 ACHE (0.64) SIGMAR1ACHECYP1A2L3MBTL1
SCHEMBL11850078 0.75 CYP1A2 (0.48) SIGMAR1ACHECYP1A2
SCHEMBL30340999 0.73 CHRM5 (0.58) SIGMAR1CYP1A2
SCHEMBL3218288 0.73 CHRM5 (0.58) SIGMAR1CYP1A2
SCHEMBL12945 0.73 CHRM5 (0.58) SIGMAR1CYP1A2
SCHEMBL24378840 0.73 WNT1 (0.34) CYP1A2CYP2D6ALOX15
SCHEMBL24378833 0.73 KDM1A (0.39) CYP1A2CYP2D6ALOX15
SCHEMBL19805957 0.72 SIGMAR1 (0.47) SIGMAR1ACHECYP1A2L3MBTL1
SCHEMBL10261041 0.72 CYP1A2 (0.47) SIGMAR1ACHECYP1A2
SCHEMBL24495782 0.72

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-20200345700-A1 LSD1 INHIBITOR AND PREPARATION METHOD AND APPLICATION THEREOF MEDSHINE DISCOVERY INC. (CN) 2020-11-05 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-20200345700-A1 LSD1 INHIBITOR AND PREPARATION METHOD AND APPLICATION THEREOF KDM1B, KDM1A, KDM2A SIGMAR1 4425/4885ACHE 2683/4885CYP1A2 357/4885

“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.