SCHEMBL15423264

SCHEMBL15423264

CC(C)CCCCN1c2ccccc2Oc2ccccc21

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 4/20 0.58
SIGMAR1 Q99720 1/20 0.50
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
TDP1 Q9NUW8 1/20 0.48
SMPD1 P17405 3/20 0.44
PPARG P37231 3/20 0.43
P2RX4 Q99571 5/20 0.41
HDAC3 O15379 1/20 0.41
TUBB4A P04350 1/20 0.41
TUBB P07437 1/20 0.41
TUBA3C P0DPH7 1/20 0.41
HDAC4 P56524 1/20 0.41
TUBA1B P68363 1/20 0.41
TUBA4A P68366 1/20 0.41
TUBB4B P68371 1/20 0.41
TUBB3 Q13509 1/20 0.41
HDAC1 Q13547 1/20 0.41
TUBB2A Q13885 1/20 0.41
TUBB8 Q3ZCM7 1/20 0.41

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
SCHEMBL765581 0.87 PIM1 (0.55) PIM1SIGMAR1MEN1KMT2ATDP1
SCHEMBL12444143 0.83 PIM1 (0.52) PIM1SIGMAR1MEN1KMT2ATDP1
SCHEMBL5953850 0.81 MEN1 (0.55) PIM1SIGMAR1MEN1KMT2ATDP1
SCHEMBL2783880 0.79 MEN1 (0.53) PIM1SIGMAR1MEN1KMT2ATDP1
SCHEMBL2254853 0.79 MEN1 (0.53) PIM1SIGMAR1MEN1KMT2ATDP1
SCHEMBL765484 0.79 PIM1 (0.51) PIM1SIGMAR1MEN1KMT2ATDP1
SCHEMBL8666818 0.79 SIGMAR1 (0.55) PIM1SIGMAR1MEN1KMT2ATDP1
SCHEMBL29759104 0.79 SIGMAR1 (0.55) PIM1SIGMAR1MEN1KMT2ATDP1
SCHEMBL29875831 0.79 SIGMAR1 (0.55) PIM1SIGMAR1MEN1KMT2ATDP1
SCHEMBL15423257 0.78 POLB (0.55) MEN1KMT2ASMPD1TP53HTR1A

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-8987321-B2 Lisofylline analogs and methods for use UNIVERSITY OF VIRGINIA PATENT FOUNDATION (US) 2015-03-24 US disclosed
US-20140018355-A1 LISOFYLLINE ANALOGS AND METHODS FOR USE UNIVERSITY OF VIRGINIA PATENT FOUNDATION (US) 2014-01-16 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-20140018355-A1 LISOFYLLINE ANALOGS AND METHODS FOR USE LPXN, LCT, SI PIM1 4759/4885SIGMAR1 1772/4885MEN1 3617/4885

“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.