SCHEMBL25096239

SCHEMBL25096239

CC(C)(C)CN1CCCCNCC1

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CXCR4 P61073 11/20 0.44
MEN1 O00255 1/20 0.39
CHRM2 P08172 1/20 0.39
CHRM1 P11229 1/20 0.39
ADRA2C P18825 1/20 0.39
CCR2 P41597 1/20 0.39
CXCL12 P48061 1/20 0.39
BLM P54132 1/20 0.39
KMT2A Q03164 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
HRH3 Q9Y5N1 1/20 0.39
SIGMAR1 Q99720 2/20 0.39
CHRM5 P08912 1/20 0.34
CHRM3 P20309 1/20 0.34
ALDH1A1 P00352 2/20 0.34
HTT P42858 1/20 0.34
POLB P06746 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL12932939 0.94 CXCR4 (0.50) CXCR4MEN1CHRM2CHRM1ADRA2C
SCHEMBL24122600 0.90 CXCR4 (0.57) CXCR4MEN1CHRM2CHRM1ADRA2C
SCHEMBL1104721 0.89 SIGMAR1 (0.44) CXCR4MEN1CHRM2CHRM1ADRA2C
Hydrochloric Acid SCHEMBL1308918 0.87 SIGMAR1 (0.43) CXCR4CHRM2CHRM1SIGMAR1CHRM5
Bromide SCHEMBL4936619 0.87 SIGMAR1 (0.43) CXCR4MEN1CHRM2CHRM1ADRA2C
SCHEMBL736306 0.82 LMNA (0.36) MEN1KMT2ATDP1HRH3SIGMAR1
SCHEMBL24122601 0.80 CXCR4 (0.38) CXCR4MEN1CHRM2CHRM1ADRA2C
SCHEMBL24122598 0.79 SIGMAR1 (0.48) CXCR4MEN1CHRM2CHRM1ADRA2C
SCHEMBL22342735 0.79 HRH3 (0.39) MEN1ADRA2CKMT2ATDP1HRH3
SCHEMBL3630893 0.79 HRH3 (0.39) MEN1ADRA2CKMT2ATDP1HRH3

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-20230070613-A1 PROTEIN TYROSINE KINASE 6 (PTK6) DEGRADATION / DISRUPTION COMPOUNDS AND METHODS OF USE ICAHN SCHOOL OF MEDICINE AT MOUNT SINAI 2023-03-09 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-20230070613-A1 PROTEIN TYROSINE KINASE 6 (PTK6) DEGRADATION / DISRUPTION COMPOUNDS AND METHODS OF USE PTK6, NEK6, GRK6 CXCR4 3843/4885MEN1 1801/4885CHRM2 4565/4885

“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.