SCHEMBL5470100

SCHEMBL5470100

O=C(c1ccc(F)cc1)N1CCC(c2ccc3c(c2)CCN(C2CCC2)CC3)CC1

nearest known ligand 0.58

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 7/20 0.58
KDM4E B2RXH2 2/20 0.58
MEN1 O00255 2/20 0.58
ALDH1A1 P00352 2/20 0.58
KMT2A Q03164 2/20 0.58
HRH3 Q9Y5N1 3/20 0.56
NPC1 O15118 1/20 0.50
RAB9A P51151 1/20 0.50
ATM Q13315 1/20 0.50
PARP10 Q53GL7 1/20 0.50
NAMPT P43490 1/20 0.50
L3MBTL3 Q96JM7 8/20 0.49
MBTD1 Q05BQ5 4/20 0.49
TP53BP1 Q12888 1/20 0.49
L3MBTL4 Q8NA19 1/20 0.49
MCHR1 Q99705 1/20 0.46
HSD11B1 P28845 1/20 0.46

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
SCHEMBL14441056 0.89 HRH3 (0.58) L3MBTL1HRH3L3MBTL3MBTD1TP53BP1
SCHEMBL5672950 0.89 L3MBTL3 (0.57) L3MBTL1KDM4EALDH1A1HRH3NAMPT
SCHEMBL5456553 0.86 HRH3 (0.53) L3MBTL1HRH3L3MBTL3MBTD1TP53BP1
SCHEMBL5464306 0.84 HRH3 (0.51) L3MBTL1HRH3L3MBTL3MBTD1TP53BP1
SCHEMBL5459981 0.83 HRH3 (0.50) L3MBTL1HRH3L3MBTL3MBTD1TP53BP1
SCHEMBL5460568 0.83 MEN1 (0.60) L3MBTL1KDM4EMEN1ALDH1A1KMT2A
SCHEMBL5465815 0.83 HPGD (0.52) L3MBTL1HRH3NAMPTL3MBTL3MBTD1
SCHEMBL5458191 0.83 HRH3 (0.58) L3MBTL1HRH3L3MBTL3
SCHEMBL5450187 0.82 HRH3 (0.55) L3MBTL1HRH3L3MBTL3
SCHEMBL5455001 0.82 GRIA3 (0.53) L3MBTL1HRH3L3MBTL3MBTD1TP53BP1

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-20070185089-A1 Benzazepine derivatives for the treatment of neurological and psychiatric disorders GLAXO GROUP LIMITED (GB) 2007-08-09 US claimed

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-20070185089-A1 Benzazepine derivatives for the treatment of neurological and psychiatric disorders CNR2, GRIN2C, GRIN2B L3MBTL1 3089/4885KDM4E 1975/4885MEN1 4497/4885

“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.