SCHEMBL10042948

SCHEMBL10042948

COc1ccc(C2=C(c3ccc(OC)cc3)c3ccc(C)cc3OC2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.50
PTGS1 P23219 2/20 0.50
ALDH1A1 P00352 2/20 0.50
KDM4E B2RXH2 1/20 0.50
NPC1 O15118 1/20 0.50
GAA P10253 1/20 0.50
ALOX12 P18054 1/20 0.50
NFKB1 P19838 1/20 0.50
HTT P42858 1/20 0.50
RAB9A P51151 1/20 0.50
NFKB2 Q00653 1/20 0.50
RELA Q04206 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
CYP19A1 P11511 1/20 0.48
ALKBH3 Q96Q83 2/20 0.46
MAOB P27338 1/20 0.45
ESR1 P03372 2/20 0.43
ESR2 Q92731 2/20 0.43
MEN1 O00255 1/20 0.41
LMNA P02545 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
SCHEMBL10042949 0.90 PTGS1 (0.52) MAPTPTGS1ALDH1A1KDM4ENPC1
SCHEMBL10071664 0.90 PTGS1 (0.54) MAPTPTGS1ALDH1A1KDM4EALOX12
SCHEMBL19295672 0.89 PREP (0.46) MAPTPTGS1ALDH1A1KDM4ENPC1
SCHEMBL243923 0.84 ESR1 (0.54) PTGS1CYP19A1MAOBESR1ESR2
SCHEMBL2568239 0.81 PTGS1 (0.56) MAPTPTGS1ALDH1A1KDM4ESMN1; SMN2
SCHEMBL4549094 0.80 MAOB (0.52) ALDH1A1NPC1NFKB1RAB9ANFKB2
SCHEMBL20997973 0.79 PREP (0.45) PTGS1CYP19A1ESR1ESR2
SCHEMBL22536183 0.78 ESR1 (0.61) PTGS1CYP19A1ESR1ESR2
SCHEMBL12404411 0.77 PTGS1 (0.76) MAPTPTGS1ALDH1A1CYP19A1MEN1
SCHEMBL2570226 0.76 CYP19A1 (0.56) MAPTPTGS1ALDH1A1KDM4ENPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20160287555-A1 SUBSTITUTED CHROMAN DERIVATIVES, MEDICAMENTS AND USE IN THERAPY NOVOGEN RESEARCH PTY LTD (AU) 2016-10-06 US disclosed
US-9381186-B2 Substituted chroman derivatives, medicaments and use in therapy MEI PHARMA, INC. (US) 2016-07-05 US disclosed
US-20150352074-A1 SUBSTITUTED CHROMAN DERIVATIVES, MEDICAMENTS AND USE IN THERAPY NOVOGEN RESEARCH PTY LTD (AU) 2015-12-10 US disclosed
US-9138478-B2 Substituted chroman derivatives, medicaments and use in therapy MEI PHARMA, INC. (US) 2015-09-22 US disclosed
US-20140170243-A1 SUBSTITUTED CHROMAN DERIVATIVES, MEDICAMENTS AND USE IN THERAPY MEI PHARMA, INC. (US) 2014-06-19 US disclosed
US-20120114766-A1 SUBSTITUTED CHROMAN DERIVATIVES, MEDICAMENTS AND USE IN THERAPY MARSHALL EDWARDS, INC. (US) 2012-05-10 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 (4 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-20150352074-A1 SUBSTITUTED CHROMAN DERIVATIVES, MEDICAMENTS AND USE IN THERAPY CDYL, XPA, TP53 MAPT 3391/4885PTGS1 2383/4885ALDH1A1 3603/4885
US-20140170243-A1 SUBSTITUTED CHROMAN DERIVATIVES, MEDICAMENTS AND USE IN THERAPY CDYL, XPA, TP53 MAPT 3391/4885PTGS1 2383/4885ALDH1A1 3603/4885
US-20120114766-A1 SUBSTITUTED CHROMAN DERIVATIVES, MEDICAMENTS AND USE IN THERAPY CDYL, XPA, TP53 MAPT 3391/4885PTGS1 2383/4885ALDH1A1 3603/4885
US-20160287555-A1 SUBSTITUTED CHROMAN DERIVATIVES, MEDICAMENTS AND USE IN THERAPY CDYL, XPA, TP53 MAPT 3391/4885PTGS1 2383/4885ALDH1A1 3603/4885

“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.