SCHEMBL4384593

SCHEMBL4384593

O=C(Cc1c(Br)c(O)cc(O)c1-c1ccccc1)N1CCCCC1

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.51
HPGD P15428 3/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
NPC1 O15118 1/20 0.46
NAAA Q02083 1/20 0.43
ALDH1A1 P00352 2/20 0.42
LMNA P02545 1/20 0.42
MEN1 O00255 1/20 0.41
RAB9A P51151 1/20 0.41
MAPT P10636 1/20 0.41
HTT P42858 2/20 0.41
POLB P06746 1/20 0.41
LIPE Q05469 1/20 0.41
GAA P10253 1/20 0.41
ALOX12 P18054 1/20 0.41

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
SCHEMBL4386243 0.88 MAPK1 (0.44) KMT2ASMN1; SMN2NPC1LMNARAB9A
SCHEMBL4379702 0.88 EGFR (0.44) KMT2AHPGDALDH1A1LMNAMEN1
SCHEMBL4386467 0.88 MAPT (0.55) KMT2ASMN1; SMN2NPC1ALDH1A1MEN1
SCHEMBL4384152 0.84 ALDH1A1 (0.58) KMT2AHPGDSMN1; SMN2ALDH1A1LMNA
SCHEMBL4386854 0.83 TACR3 (0.52) KMT2AALDH1A1MEN1RAB9AMAPT
SCHEMBL6025387 0.82 RAB9A (0.55) KMT2AHPGDSMN1; SMN2NPC1ALDH1A1
SCHEMBL4386601 0.81 ALDH1A1 (0.62) KMT2AHPGDSMN1; SMN2ALDH1A1LMNA
SCHEMBL4380223 0.81 SMN1; SMN2 (0.42) KMT2AHPGDSMN1; SMN2ALDH1A1LMNA
SCHEMBL4394430 0.80 ALDH1A1 (0.46) KMT2AALDH1A1RAB9AMAPTHTT
SCHEMBL4380891 0.79 POLB (0.53) KMT2ASMN1; SMN2ALDH1A1LMNAMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1669189-B1 RESIN-COATED METAL PLATE AND DRAWN CAN USING THE SAME TOYO SEIKAN KAISHA LTD (JP) 2009-11-25 EP disclosed
US-7538241-B2 Hsp90 family protein inhibitors KYOWA HAKKO KOGYO CO., LTD. (JP) 2009-05-26 US disclosed
US-20070155813-A1 Hsp90 family protein inhibitors KYOWA HAKKO KOGYO CO., LTD. (JP) 2007-07-05 US disclosed
EP-1704856-A1 HSP90 FAMILY PROTEIN INHIBITOR KYOWA HAKKO KOGYO CO., LTD. (JP) 2006-09-27 EP 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-20070155813-A1 Hsp90 family protein inhibitors HSP90AB1, HEATR1, HSP90AB2P KMT2A 3994/4885HPGD 3238/4885SMN1; SMN2 4471/4885

“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.