SCHEMBL20683271

SCHEMBL20683271

CN1CCCN(N2CCN(C(=O)C3CCOCC3)CC2)CC1

nearest known ligand 0.64

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.64
LMNA P02545 1/20 0.62
HRH3 Q9Y5N1 2/20 0.46
CNR2 P34972 8/20 0.45
TSHR P16473 2/20 0.44
ALDH1A1 P00352 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.43
HPGD P15428 2/20 0.41
RECQL P46063 1/20 0.40
POLB P06746 1/20 0.40
GPR183 P32249 1/20 0.40
KCNH2 Q12809 1/20 0.40
PPP5C P53041 1/20 0.40
PPP2CA P67775 1/20 0.40

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
SCHEMBL4036894 0.89 HTT (0.62) HTTLMNAHRH3CNR2TSHR
SCHEMBL26159917 0.80 HTT (0.60) HTTLMNAHRH3CNR2TSHR
SCHEMBL21584689 0.79 HTT (0.54) HTTLMNAHRH3CNR2TSHR
SCHEMBL25629645 0.79 HTT (0.54) HTTLMNAHRH3CNR2TSHR
SCHEMBL12632681 0.79 LMNA (0.89) HTTLMNATSHRALDH1A1SMN1; SMN2
SCHEMBL14277548 0.77 LMNA (1.00) HTTLMNACNR2TSHRALDH1A1
SCHEMBL12632672 0.76 LMNA (0.79) HTTLMNATSHRALDH1A1SMN1; SMN2
SCHEMBL18415359 0.76 HPGD (0.68) HTTLMNAHRH3CNR2TSHR
SCHEMBL4135869 0.76 LMNA (0.85) HTTLMNATSHRALDH1A1SMN1; SMN2
SCHEMBL2075903 0.76 HTT (0.81) HTTLMNATSHRALDH1A1HPGD

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
US-10472352-B2 Rac inhibitors Geneyus LLC (US) 2019-11-12 US disclosed
US-20190031647-A1 RAC INHIBITORS Geneyus LLC (US) 2019-01-31 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 (2 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-20190031647-A1 RAC INHIBITORS ARHGDIB, ARHGDIA, RAC1 HTT 3520/4885LMNA 3071/4885HRH3 2631/4885
US-10472352-B2 Rac inhibitors ARHGDIB, ARHGDIA, RAC1 HTT 3520/4885LMNA 3071/4885HRH3 2631/4885

“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.