SCHEMBL4522249

SCHEMBL4522249

Cc1cc(Br)c(NC(=O)CN2CCN(CCO)CC2)c(Br)n1

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.54
ALDH1A1 P00352 3/20 0.48
ALOX15 P16050 1/20 0.48
HSD17B10 Q99714 1/20 0.47
LMNA P02545 1/20 0.44
KDM4E B2RXH2 3/20 0.44
DRD4 P21917 1/20 0.44
MEN1 O00255 3/20 0.43
KMT2A Q03164 3/20 0.43
POLB P06746 2/20 0.43
NPC1 O15118 1/20 0.42
HPGD P15428 1/20 0.42
TP53 P04637 1/20 0.42
MAPT P10636 1/20 0.42

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
SCHEMBL4505557 0.78 HSD17B10 (0.56) RAB9AALDH1A1ALOX15HSD17B10LMNA
SCHEMBL4513891 0.76 SOAT1 (0.65) RAB9AALDH1A1ALOX15HSD17B10LMNA
SCHEMBL4514770 0.75 LMNA (0.54) ALDH1A1ALOX15HSD17B10LMNAKDM4E
SCHEMBL4827078 0.75 HSD17B10 (0.47) RAB9AALDH1A1ALOX15HSD17B10LMNA
SCHEMBL4513169 0.74 MEN1 (0.45) RAB9AALDH1A1ALOX15HSD17B10LMNA
SCHEMBL4506634 0.74 ALDH1A1 (0.46) RAB9AALDH1A1HSD17B10KDM4EMEN1
SCHEMBL6281135 0.74 SOAT1 (0.52) RAB9AALDH1A1ALOX15HSD17B10LMNA
SCHEMBL6277357 0.73 SOAT1 (0.49) RAB9AALDH1A1ALOX15HSD17B10LMNA
SCHEMBL4532301 0.73 LMNA (0.44) ALDH1A1ALOX15HSD17B10LMNAKDM4E
SCHEMBL4521151 0.72 KDM4E (0.44) ALDH1A1ALOX15HSD17B10LMNAKDM4E

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-7560547-B2 Hydroxyalkyl cyclic diamine compounds KOWA CO., LTD. (JP) 2009-07-14 US disclosed
US-20070088159-A1 HYDROXYALKYL CYCLIC DIAMINE COMPOUNDS KOWA CO., LTD. (JP) 2007-04-19 US disclosed
US-7176306-B2 Hydroxyalkyl cyclic diamine compound KOWA CO., LTD. (JP) 2007-02-13 US disclosed
EP-1571144-A1 HYDROXYALKYLATED CYCLIC DIAMINE COMPOUND Kowa Co., Ltd. (JP) 2005-09-07 EP disclosed
US-20040176593-A1 Hydroxyalkyl cyclic diamine compound KOWA CO., LTD. (JP) 2004-09-09 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-20040176593-A1 Hydroxyalkyl cyclic diamine compound DDC, AOC1, ODC1 RAB9A 2895/4885ALDH1A1 45/4885ALOX15 1469/4885
US-20070088159-A1 HYDROXYALKYL CYCLIC DIAMINE COMPOUNDS HDHD5, DDC, DDT RAB9A 2612/4885ALDH1A1 146/4885ALOX15 1731/4885

“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.