SCHEMBL4085436

SCHEMBL4085436

C=C1CC1(c1ccccc1)c1cc(Br)cc(Br)c1

nearest known ligand 0.34

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDM1A O60341 1/20 0.34
RCOR1 Q9UKL0 1/20 0.34
ALDH1A1 P00352 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
MEN1 O00255 1/20 0.32
RGS12 O14924 1/20 0.32
CYP3A4 P08684 1/20 0.32
KMT2A Q03164 1/20 0.32
MAOB P27338 6/20 0.31
MAOA P21397 3/20 0.31
EGFR P00533 2/20 0.31
KCNH2 Q12809 1/20 0.30

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
SCHEMBL27750433 1.00 KDM1A (0.34) KDM1ARCOR1ALDH1A1TDP1MEN1
SCHEMBL4096847 0.84 KDM1A (0.43) KDM1ARCOR1ALDH1A1TDP1MEN1
SCHEMBL4095120 0.83 MAOB (0.41) KDM1AMAOBMAOAEGFRKCNH2
SCHEMBL4082596 0.77 SLC6A2 (0.36) ALDH1A1MEN1RGS12CYP3A4KMT2A
SCHEMBL4096980 0.74 ALDH1A1 (0.39) KDM1AALDH1A1TDP1CYP3A4MAOB
SCHEMBL23795263 0.73 MAPT (0.35) ALDH1A1TDP1MEN1KMT2A
SCHEMBL4083002 0.72 SLC6A4 (0.41) KDM1ARCOR1CYP3A4
SCHEMBL4099398 0.63 SLC6A3 (0.39) KDM1AALDH1A1TDP1MEN1CYP3A4
SCHEMBL26378418 0.61 MEN1 (0.50) ALDH1A1TDP1MEN1KMT2A
SCHEMBL4082808 0.61 CCR2 (0.42) KDM1AALDH1A1MEN1RGS12CYP3A4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-100512582-C Light emitting system, light emitting method and chemical substance for light emission HITACHI CHEMICAL CO LTD (JP) 2009-07-08 CN disclosed
US-20090163743-A1 LUMINESCENCE SYSTEM, METHOD OF LUMINESCENCE, AND CHEMICAL SUBSTANCE FOR LUMINESCENCE HOSHI YOUSUKE 2009-06-25 US disclosed
US-20070138945-A1 Luminescence system, method of luminescence, and chemical substance for luminescence HITACHI CHIEMICAL CO., LTD., (JP) 2007-06-21 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-20070138945-A1 Luminescence system, method of luminescence, and chemical substance for luminescence GLO1, TYR, GUSB KDM1A 3827/4885RCOR1 3332/4885ALDH1A1 48/4885
US-20090163743-A1 LUMINESCENCE SYSTEM, METHOD OF LUMINESCENCE, AND CHEMICAL SUBSTANCE FOR LUMINESCENCE GLO1, TYR, GUSB KDM1A 3827/4885RCOR1 3332/4885ALDH1A1 48/4885

“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.