SCHEMBL20378494

SCHEMBL20378494

CC(C)Cc1ccc(C(C)CN2CCN(CCCC[C@H]3CNCCN3CCc3cc(C(F)(F)F)cc(C(F)(F)F)c3)C[C@@H]2c2ccccc2)cc1

nearest known ligand 0.75

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ZDHHC9 Q9Y397 2/20 0.75
MITF O75030 1/20 0.49
IDE P14735 2/20 0.44
UBE2N P61088 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
APAF1 O14727 1/20 0.41
NPSR1 Q6W5P4 2/20 0.39
ATM Q13315 1/20 0.39
RAD52 P43351 1/20 0.35
MEN1 O00255 1/20 0.34
MAPK1 P28482 1/20 0.34
KMT2A Q03164 1/20 0.34
POLB P06746 1/20 0.34
MAPT P10636 1/20 0.34
RECQL P46063 1/20 0.34
TAAR1 Q96RJ0 1/20 0.33
CCR2 P41597 3/20 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
SCHEMBL20378498 1.00 ZDHHC9 (0.75) ZDHHC9MITFIDEUBE2NL3MBTL1
SCHEMBL20378484 0.86 ZDHHC9 (1.00) ZDHHC9MITFIDEUBE2NL3MBTL1
SCHEMBL20511977 0.86 ZDHHC9 (1.00) ZDHHC9MITFIDEUBE2NL3MBTL1
SCHEMBL20378481 0.86 ZDHHC9 (1.00) ZDHHC9MITFIDEUBE2NL3MBTL1
SCHEMBL20378460 0.80 MITF (0.52) ZDHHC9MITFIDEUBE2NL3MBTL1
SCHEMBL20511974 0.80 MITF (0.52) ZDHHC9MITFIDEUBE2NL3MBTL1
SCHEMBL20511978 0.75 ZDHHC9 (0.77) ZDHHC9TAAR1
SCHEMBL20511975 0.75 ZDHHC9 (0.77) ZDHHC9TAAR1
SCHEMBL20511973 0.73 ZDHHC9 (1.00) ZDHHC9L3MBTL1MAPT
SCHEMBL20378504 0.69 ZDHHC9 (0.64) ZDHHC9ATMTAAR1

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-10085981-B2 Protein acyl transferase inhibitors and methods of treatment UNIVERSITY OF SOUTH FLORIDA (US) 2018-10-02 US disclosed
US-20180200250-A1 PROTEIN ACYL TRANSFERASE INHIBITORS AND METHODS OF TREATMENT UNIVERSITY OF SOUTH FLORIDA (US) 2018-07-19 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-10085981-B2 Protein acyl transferase inhibitors and methods of treatment ACAT2, LCAT, PLAAT2 ZDHHC9 88/4885MITF 2270/4885IDE 395/4885
US-20180200250-A1 PROTEIN ACYL TRANSFERASE INHIBITORS AND METHODS OF TREATMENT ACAT2, LCAT, PLAAT2 ZDHHC9 88/4885MITF 2270/4885IDE 395/4885

“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.