SCHEMBL10028336

SCHEMBL10028336

COc1cc2c(cc1OC)CN(Cc1cccc(C(C)C)c1)CC2

nearest known ligand 0.70

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 0.61
TDP1 Q9NUW8 1/20 0.61
KMT2A Q03164 1/20 0.60
REV1 Q9UBZ9 1/20 0.58
MAPT P10636 3/20 0.58
GAA P10253 1/20 0.58
RAB9A P51151 1/20 0.58
ABCB1 P08183 8/20 0.58
ABCC1 P33527 5/20 0.58
ABCG2 Q9UNQ0 2/20 0.58
ALDH1A1 P00352 3/20 0.55
TSHR P16473 2/20 0.55
ALOX15 P16050 1/20 0.55
CASP1 P29466 1/20 0.55
CASP7 P55210 1/20 0.55
HSD17B10 Q99714 1/20 0.55
HTT P42858 1/20 0.51
NPSR1 Q6W5P4 1/20 0.51
TAAR1 Q96RJ0 1/20 0.51
CA2 P00918 1/20 0.51

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
SCHEMBL5120567 0.86 REV1 (0.57) KDM4ETDP1KMT2AREV1MAPT
SCHEMBL5131462 0.82 KDM4E (0.71) KDM4ETDP1KMT2AREV1MAPT
SCHEMBL5129280 0.81 REV1 (0.66) KDM4ETDP1KMT2AREV1MAPT
SCHEMBL5130886 0.80 REV1 (0.67) KDM4ETDP1KMT2AREV1MAPT
SCHEMBL5128393 0.79 REV1 (0.69) KDM4ETDP1KMT2AREV1MAPT
SCHEMBL10028313 0.79 KDM4E (0.62) KDM4ETDP1KMT2AREV1MAPT
SCHEMBL5125365 0.79 ABCB1 (0.69) KDM4ETDP1KMT2AREV1MAPT
SCHEMBL3810641 0.78 KMT2A (0.76) KDM4ETDP1KMT2AREV1MAPT
SCHEMBL3058994 0.78 REV1 (0.64) KDM4ETDP1KMT2AREV1MAPT
SCHEMBL3052881 0.77 KDM4E (0.70) KDM4ETDP1REV1MAPTGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9402824-B2 9,10-α, α-OH-taxane analogs and methods for production thereof TAPESTRY PHARMACEUTICALS, INC. (US) 2016-08-02 US disclosed
US-20150133536-A1 9, 10-Alpha, Alpha-OH-Taxane Analogs and Methods for Production Thereof TAPESTRY PHARMACEUTICALS, INC. (US) 2015-05-14 US disclosed
US-8962870-B2 9, 10-α, α-OH-taxane analogs and methods for production thereof TAPESTRY PHARMACEUTICALS, INC. (US) 2015-02-24 US disclosed
US-20120077871-A1 9, 10-Alpha, Alpha-OH-Taxane Analogs and Methods for Production Thereof TAPESTRY PHARMACEUTICALS, INC. (US) 2012-03-29 US disclosed
US-20120077871-A1 9, 10-Alpha, Alpha-OH-Taxane Analogs and Methods for Production Thereof TAPESTRY PHARMACEUTICALS, INC. (US) 2012-03-29 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-20120077871-A1 9, 10-Alpha, Alpha-OH-Taxane Analogs and Methods for Production Thereof TECR, ADCY9, AKR1C3 KDM4E 4743/4885TDP1 2434/4885KMT2A 3997/4885
US-20150133536-A1 9, 10-Alpha, Alpha-OH-Taxane Analogs and Methods for Production Thereof TECR, ADCY9, AKR1C3 KDM4E 4743/4885TDP1 2434/4885KMT2A 3997/4885

“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.