SCHEMBL16634241

SCHEMBL16634241

COc1cc(Br)cnc1/C=C/C(=O)O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 8/20 0.48
GAA P10253 1/20 0.48
ALDH1A1 P00352 4/20 0.46
SMN1; SMN2 Q16637 3/20 0.46
HPGD P15428 2/20 0.46
HSD17B10 Q99714 2/20 0.46
PKM P14618 2/20 0.46
PTGS2 P35354 2/20 0.46
HTR1A P08908 1/20 0.46
HTR2C P28335 1/20 0.46
PTGS1 P23219 1/20 0.46
ALOX15 P16050 1/20 0.45
MAPK1 P28482 1/20 0.45
SNCA P37840 2/20 0.43
CA1 P00915 2/20 0.43
CA2 P00918 2/20 0.43
CA12 O43570 1/20 0.43
CA3 P07451 1/20 0.43
CSNK2A2 P19784 1/20 0.43
CA4 P22748 1/20 0.43

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
SCHEMBL16634242 1.00 KDM4E (0.48) KDM4EGAAALDH1A1SMN1; SMN2HPGD
SCHEMBL15278597 0.82 ESR1 (0.37) KDM4EGAACA1CA2ERN1
SCHEMBL16634233 0.80 KDM4E (0.39) KDM4EGAAALDH1A1SMN1; SMN2HPGD
SCHEMBL16634234 0.80 KDM4E (0.39) KDM4EGAAALDH1A1SMN1; SMN2HPGD
SCHEMBL17161019 0.77 ERN1 (0.46) KDM4EALDH1A1SMN1; SMN2HPGDPOLB
SCHEMBL16634172 0.76 MIF (0.39) KDM4EGAAALDH1A1SMN1; SMN2CSNK2A2
SCHEMBL16634171 0.76 MIF (0.39) KDM4EGAAALDH1A1SMN1; SMN2CSNK2A2
SCHEMBL2258552 0.76 KDM4E (0.42) KDM4EGAAALDH1A1SMN1; SMN2HPGD
SCHEMBL2258547 0.76 KDM4E (0.42) KDM4EGAAALDH1A1SMN1; SMN2HPGD
SCHEMBL23122299 0.76 ALDH1A1 (0.72) KDM4EGAAALDH1A1SMN1; SMN2HPGD

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
EP-2828243-B1 ESTROGEN RECEPTOR MODULATORS AND USES THEREOF SERAGON PHARMACEUTICALS INC (US) 2018-10-17 EP disclosed
US-9499538-B2 Estrogen receptor modulators and uses thereof SERAGON PHARMACEUTICALS, INC. (US) 2016-11-22 US disclosed
US-20150105403-A1 ESTROGEN RECEPTOR MODULATORS AND USES THEREOF SERAGON PHARMACEUTICALS, INC. 2015-04-16 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 (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-20150105403-A1 ESTROGEN RECEPTOR MODULATORS AND USES THEREOF ESR2, ESRRG, GPER1 KDM4E 2785/4885GAA 2780/4885ALDH1A1 1178/4885

“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.