SCHEMBL4835322

SCHEMBL4835322

CC(C)(c1ccc(NC(=O)CCc2nncn2-c2ccc(F)cc2)cc1)P(=O)(O)O

nearest known ligand 0.43

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
RXFP1 Q9HBX9 5/20 0.41
ATM Q13315 2/20 0.40
RAB9A P51151 2/20 0.40
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
LMNA P02545 3/20 0.39
GAA P10253 2/20 0.39
ALDH1A1 P00352 1/20 0.39
TSHR P16473 1/20 0.39
MAPT P10636 3/20 0.38
TP53 P04637 2/20 0.38
NPSR1 Q6W5P4 1/20 0.38
NPC1 O15118 1/20 0.37
MCHR1 Q99705 1/20 0.36

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
SCHEMBL4836514 0.89 RAB9A (0.41) RXFP1ATMRAB9AMEN1KMT2A
SCHEMBL27632023 0.83 RAB9A (0.43) RXFP1ATMRAB9AMEN1KMT2A
SCHEMBL4833529 0.83 ENPP2 (0.45) RXFP1ATMRAB9AMEN1KMT2A
SCHEMBL4836707 0.83 RXFP1 (0.40) RXFP1RAB9AMEN1KMT2ALMNA
SCHEMBL4835333 0.80 ATM (0.41) RXFP1ATMRAB9AMEN1KMT2A
SCHEMBL4836520 0.79 TP53 (0.42) RXFP1ATMRAB9AMEN1KMT2A
SCHEMBL4831213 0.78 MAOB (0.47) RAB9AMEN1KMT2ALMNAALDH1A1
SCHEMBL4831254 0.78 MAOB (0.47) RAB9AMEN1KMT2ALMNAALDH1A1
SCHEMBL6432392 0.76 RAB9A (0.40) RXFP1ATMRAB9AMEN1KMT2A
SCHEMBL6432385 0.75 RAB9A (0.40) RXFP1ATMRAB9AMEN1KMT2A

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-20080287438-A1 Agent for preventing or treating neuropathy MOMOSE YU 2008-11-20 US disclosed
US-7423159-B2 Agent for preventing or treating neuropathy TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2008-09-09 US disclosed
US-20060004069-A1 Agent for preventing or treating neuropathy TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2006-01-05 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-20060004069-A1 Agent for preventing or treating neuropathy NR2C2, NR0B2, NR2E1 RXFP1 1603/4885ATM 3758/4885RAB9A 4059/4885
US-20080287438-A1 Agent for preventing or treating neuropathy NR2C2, NR0B2, NR2E1 RXFP1 1603/4885ATM 3758/4885RAB9A 4059/4885

“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.