SCHEMBL22255172

SCHEMBL22255172

CCCCCCCC(CCCCCCC)n1ccc(C)n1

nearest known ligand 0.36

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.34
NPSR1 Q6W5P4 3/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
NPC1 O15118 4/20 0.32
RAB9A P51151 4/20 0.32
HTT P42858 3/20 0.32
GALR3 O60755 2/20 0.32
POLB P06746 2/20 0.32
ATM Q13315 2/20 0.32
MAPK1 P28482 2/20 0.32
KDM4E B2RXH2 1/20 0.32
HSP90AA1 P07900 1/20 0.32
MAPT P10636 1/20 0.32
RAD52 P43351 1/20 0.32
PAX8 Q06710 1/20 0.32
NR2F2 P24468 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
SCHEMBL24253461 0.81 NPC1 (0.39) NPC1RAB9AHSP90AA1SMN1; SMN2
SCHEMBL24253420 0.78 IDH1 (0.36) LMNAHTTKDM4EMAPTSMN1; SMN2
SCHEMBL24253246 0.78 CYP19A1 (0.35) HTTKDM4E
SCHEMBL10205365 0.77 LMNA (0.39) LMNANPSR1KMT2ANPC1RAB9A
SCHEMBL20898646 0.75 ADA (0.36) LMNAMEN1KMT2AMAPK1HSP90AA1
SCHEMBL24253277 0.72 ADA (0.34)
SCHEMBL24253220 0.72 CYP19A1 (0.39)
SCHEMBL19035608 0.72 ADA (0.36) NPSR1MEN1KMT2A
SCHEMBL21514093 0.71 PRSS1 (0.37) LMNANPSR1MEN1KMT2AMAPK1
SCHEMBL18814959 0.71 LMNA (0.34) LMNANPSR1MEN1KMT2A

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-20200231570-A1 HETEROCYCLIC COMPOUNDS AS ADENOSINE ANTAGONISTS SAGARD HOLDINGS MANAGER LP, AS ADMINISTRATIVE AGENT (CA) 2020-07-23 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-20200231570-A1 HETEROCYCLIC COMPOUNDS AS ADENOSINE ANTAGONISTS ADORA2A, ADORA3, ADORA1 LMNA 4458/4885NPSR1 741/4885MEN1 2327/4885

“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.