SCHEMBL3464639

SCHEMBL3464639

C=Cc1cc2c(cc1Br)OCO2

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.47
KMT2A Q03164 4/20 0.47
IGF1R P08069 1/20 0.47
PKM P14618 1/20 0.45
ALDH1A1 P00352 4/20 0.44
HPGD P15428 3/20 0.44
HTT P42858 1/20 0.44
ABL1 P00519 1/20 0.41
SRC P12931 1/20 0.41
MAPT P10636 4/20 0.40
SMN1; SMN2 Q16637 4/20 0.40
CYP1A2 P05177 2/20 0.39
CYP3A4 P08684 2/20 0.39
KDM4E B2RXH2 4/20 0.39
CYP2C19 P33261 1/20 0.39
RECQL P46063 1/20 0.39
NPC1 O15118 2/20 0.38
RAB9A P51151 2/20 0.38
LMNA P02545 2/20 0.38
POLB P06746 1/20 0.38

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
SCHEMBL583659 0.79 HPGD (0.55) MEN1KMT2AIGF1RPKMALDH1A1
SCHEMBL29624374 0.79 HPGD (0.55) MEN1KMT2AIGF1RPKMALDH1A1
SCHEMBL1751672 0.77 AHR (0.53) MEN1KMT2AIGF1RPKMALDH1A1
SCHEMBL16420014 0.76 KMT2A (0.49) MEN1KMT2AIGF1RPKMALDH1A1
SCHEMBL6212532 0.75 ALDH1A1 (0.44) MEN1KMT2AALDH1A1HPGDMAPT
SCHEMBL4143129 0.75 CYP3A4 (0.39) MEN1KMT2AIGF1RPKMALDH1A1
SCHEMBL9837031 0.74 ALDH1A1 (0.32) ALDH1A1
SCHEMBL9871731 0.71 MEN1 (0.40) MEN1KMT2AIGF1RPKMALDH1A1
SCHEMBL7308321 0.71 KDM4E (0.54) MEN1KMT2AIGF1RPKMALDH1A1
SCHEMBL16053235 0.71 CYP19A1 (0.58) ALDH1A1CYP1A2CYP3A4KDM4ENPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119118761-B Method for preparing unprotected beta-amino fluoride by iron-catalyzed olefin ammofluorination 东北师范大学 2025-01-10 CN claimed
CN-119118761-A Method for preparing unprotected beta-amino fluoride by iron-catalyzed olefin ammofluorination 东北师范大学 2024-12-13 CN claimed
CN-119118761-B Method for preparing unprotected beta-amino fluoride by iron-catalyzed olefin ammofluorination 东北师范大学 2025-01-10 CN disclosed
CN-119118761-A Method for preparing unprotected beta-amino fluoride by iron-catalyzed olefin ammofluorination 东北师范大学 2024-12-13 CN disclosed
US-20100240656-A1 COMPOUNDS AS HSP90 INHIBITORS ORYZON GENOMICS, S.A. (ES) 2010-09-23 US disclosed
EP-2183221-A1 NEW COMPOUNDS AS HSP90 INHIBITORS Crystax Pharmaceuticals S.L. (ES) 2010-05-12 EP disclosed
WO-2009007399-A1 NEW COMPOUNDS AS HSP90 INHIBITORS CRYSTAX PHARMACEUTICALS, S.L. (ES) 2009-01-15 WO 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-20100240656-A1 COMPOUNDS AS HSP90 INHIBITORS HSP90AB1, HSP90AB2P, HSP90AA1 MEN1 4594/4885KMT2A 4661/4885IGF1R 2647/4885

“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.