SCHEMBL16523027

SCHEMBL16523027

O=C(CN1CCCCC1)C1(c2ccc(Cl)cc2)CCC1

nearest known ligand 0.62

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ HSD11B1 P28845 8/20 0.62
▸ ALDH1A1 P00352 3/20 0.48
▸ HDAC4 P56524 1/20 0.48
▸ ATM Q13315 1/20 0.44
▸ KDM4E B2RXH2 1/20 0.44
▸ LMNA P02545 1/20 0.43
▸ SIGMAR1 Q99720 1/20 0.43
▸ GFER P55789 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ USP14 P54578 1/20 0.42
▸ USP7 Q93009 1/20 0.42
▸ NPC1 O15118 1/20 0.42
▸ OPRM1 P35372 1/20 0.42

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
SCHEMBL16507031 0.85 KMT2A (0.56) HSD11B1ALDH1A1HDAC4KDM4ELMNA
SCHEMBL16506928 0.85 CHRM2 (0.57) HSD11B1KDM4ESIGMAR1SMN1; SMN2OPRM1
SCHEMBL8351554 0.84 USP2 (0.45) HSD11B1ALDH1A1LMNASIGMAR1SMN1; SMN2
Hydrochloric Acid SCHEMBL16507430 0.84 MAPK1 (0.58) HSD11B1ALDH1A1HDAC4KDM4ELMNA
SCHEMBL16523531 0.83 MEN1 (0.45) HSD11B1ALDH1A1ATMNPC1
SCHEMBL19242638 0.82 KMT2A (0.60) HSD11B1ALDH1A1HDAC4KDM4ELMNA
SCHEMBL16507502 0.82 CHRM2 (0.60) HSD11B1SMN1; SMN2OPRM1
Hydrochloric Acid SCHEMBL16507309 0.81 CHRM2 (0.58) HSD11B1OPRM1
SCHEMBL8351183 0.81 HPGD (0.46) HSD11B1ALDH1A1LMNASIGMAR1SMN1; SMN2
SCHEMBL8353497 0.81 USP2 (0.45) HSD11B1LMNASIGMAR1SMN1; SMN2NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2015027058-A2 CYCLOLKYL AMINE COMPOUNDS PREXA PHARMACEUTICALS, INC. (US) 2015-02-26 — — WO disclosed
US-20150057443-A1 Cycloalkyl Amine Compounds PREXA PHARMACEUTICALS, INC. 2015-02-26 — — 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-20150057443-A1 Cycloalkyl Amine Compounds HCRTR2, HCRTR1, HTR2C HSD11B1 422/4885ALDH1A1 887/4885HDAC4 3162/4885

“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.

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