SCHEMBL19749072

SCHEMBL19749072

CCC(C)(C)c1ccc(C2CCNCC2)cc1

nearest known ligand 0.59

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 2/20 0.59
CNR2 P34972 15/20 0.55
SLC18A3 Q16572 1/20 0.48
SIGMAR1 Q99720 1/20 0.48
QDPR P09417 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
SCHEMBL300623 0.82 HTR2C (0.67) HTR2CSLC18A3SIGMAR1QDPR
Hydrochloric Acid SCHEMBL23858205 0.80 HTR2C (0.68) HTR2CSLC18A3SIGMAR1QDPR
SCHEMBL8047163 0.79 HTR2C (0.73) HTR2CSLC18A3SIGMAR1QDPR
SCHEMBL30228302 0.79 HTR2C (0.62) HTR2CSLC18A3SIGMAR1QDPR
SCHEMBL15317742 0.76 HTR2C (0.59) HTR2CCNR2SLC18A3SIGMAR1QDPR
SCHEMBL19731506 0.74 HTR2C (0.46) HTR2CCNR2SLC18A3SIGMAR1
SCHEMBL373310 0.74 HTR2C (1.00) HTR2CSLC18A3SIGMAR1QDPR
Enefexine SCHEMBL499360 0.74 SLC18A3 (0.55) HTR2CSLC18A3SIGMAR1QDPR
SCHEMBL14684852 0.74 HTR2C (0.51) HTR2CSLC18A3SIGMAR1QDPR
SCHEMBL22692974 0.73 CNR2 (0.49) CNR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10017478-B2 Inhibitors of ACK1/TNK2 tyrosine kinase H. LEE MOFFITT CANCER CENTER AND RESEARCH INSTITUTE, INC. (US) 2018-07-10 US disclosed
US-20180155297-A1 INHIBITORS OF ACK1/TNK2 TYROSINE KINASE H. LEE MOFFITT CANCER CENTER AND RESEARCH INSTITUTE, INC. 2018-06-07 US disclosed
US-9850216-B2 Inhibitors of ACK1/TNK2 tyrosine kinase H. LEE MOFFITT CANCER CENTER AND RESEARCH INSTITUTE, INC. (US) 2017-12-26 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 (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-10017478-B2 Inhibitors of ACK1/TNK2 tyrosine kinase TNK1, TNNI3K, TNK2 HTR2C 3493/4885CNR2 2766/4885SLC18A3 2543/4885
US-20180155297-A1 INHIBITORS OF ACK1/TNK2 TYROSINE KINASE TNK1, TNNI3K, TNK2 HTR2C 3493/4885CNR2 2766/4885SLC18A3 2543/4885

“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.