SCHEMBL4485578

SCHEMBL4485578

O=C1c2c(F)cccc2OCC2CCCCN12

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.40
MEN1 O00255 2/20 0.40
NPC1 O15118 2/20 0.40
RAB9A P51151 2/20 0.40
ATM Q13315 1/20 0.40
AR P10275 2/20 0.39
ABCB1 P08183 1/20 0.39
HTR2C P28335 1/20 0.39
HTR2B P41595 1/20 0.39
DGAT1 O75907 1/20 0.36
POLB P06746 1/20 0.36
PARP1 P09874 1/20 0.36
HTT P42858 1/20 0.36
ESR2 Q92731 1/20 0.36
CNR1 P21554 2/20 0.35
PARP2 Q9UGN5 1/20 0.35
CYP19A1 P11511 1/20 0.35
LMNA P02545 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
LTA4H P09960 1/20 0.34

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
SCHEMBL4491538 0.96 HTR2C (0.39) KMT2AMEN1NPC1RAB9AATM
SCHEMBL4485561 0.96 HTR2C (0.39) KMT2AMEN1NPC1RAB9AATM
SCHEMBL34468227 0.82 ALDH1A1 (0.40) KMT2AMEN1NPC1RAB9AATM
SCHEMBL12714452 0.80 TMEM97 (0.44) KMT2AMEN1NPC1RAB9AATM
SCHEMBL12715076 0.80 HTR2B (0.45) KMT2AMEN1NPC1RAB9AATM
SCHEMBL4486412 0.80 TMEM97 (0.44) KMT2AMEN1NPC1RAB9AATM
SCHEMBL12715110 0.80 HTR2B (0.45) KMT2AMEN1NPC1RAB9AATM
SCHEMBL12714484 0.80 TMEM97 (0.44) KMT2AMEN1NPC1RAB9AATM
SCHEMBL10229055 0.80 HTR2B (0.45) KMT2AMEN1NPC1RAB9AATM
SCHEMBL4479747 0.80 HTR2A (0.42) KMT2AMEN1NPC1RAB9AATM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7504390-B2 Benzoxazepine derivatives and their use as AMPA receptor stimulators N.V. ORGANON (NL) 2009-03-17 US disclosed
US-20080139529-A1 BENZOXAPZEPINE DERIVATIVES AND THEIR USE AS AMPA RECEPTOR STIMULATORS N.V. ORGANON (NL) 2008-06-12 US disclosed
EP-1399450-B1 BENZOXAZEPINE DERIVATIVES AND THEIR USE AS AMPA RECEPTOR STIMULATORS ORGANON NV (NL) 2008-03-19 EP disclosed
US-7307073-B2 Benzoxazepines derivatives and their use as AMPA receptor stimulators N.V. ORGANON (NL) 2007-12-11 US disclosed
US-20040171605-A1 Benzoxazepines derivatives and their use as ampa receptor stimulators MERCK SHARP & DOHME B.V. (NL) 2004-09-02 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-20040171605-A1 Benzoxazepines derivatives and their use as ampa receptor stimulators CHRNA4, CHRNA10, CHRNA9 KMT2A 2555/4885MEN1 4866/4885NPC1 2380/4885
US-20080139529-A1 BENZOXAPZEPINE DERIVATIVES AND THEIR USE AS AMPA RECEPTOR STIMULATORS GRIN1, GRIA4, CHRNA4 KMT2A 2258/4885MEN1 4584/4885NPC1 2019/4885

“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.