SCHEMBL19146396

SCHEMBL19146396

COc1cc2[nH]c(=O)cc(C)c2cc1OC

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NQO2 P16083 5/20 0.60
CYP19A1 P11511 3/20 0.60
KDM4E B2RXH2 6/20 0.59
ALDH1A1 P00352 4/20 0.58
HPGD P15428 4/20 0.58
SMN1; SMN2 Q16637 3/20 0.58
TNKS2 Q9H2K2 2/20 0.55
GRIN2D O15399 1/20 0.53
GRIN3B O60391 1/20 0.53
GRIN1 Q05586 1/20 0.53
GRIN2A Q12879 1/20 0.53
GRIN2B Q13224 1/20 0.53
GRIN2C Q14957 1/20 0.53
GRIN3A Q8TCU5 1/20 0.53
MAPT P10636 2/20 0.50
KMT2A Q03164 2/20 0.50
MEN1 O00255 1/20 0.50
MPO P05164 1/20 0.49
XDH P47989 1/20 0.49
BLM P54132 1/20 0.49

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
SCHEMBL31664560 0.86 KDM4E (0.59) NQO2CYP19A1KDM4EALDH1A1HPGD
SCHEMBL26607699 0.86 KDM4E (0.53) NQO2CYP19A1KDM4EALDH1A1HPGD
SCHEMBL16896940 0.86 GRIN2D (0.57) NQO2CYP19A1KDM4EALDH1A1HPGD
SCHEMBL12047270 0.86 NQO2 (0.54) NQO2CYP19A1KDM4EALDH1A1HPGD
SCHEMBL8700898 0.86 NQO2 (0.54) NQO2CYP19A1KDM4EALDH1A1HPGD
SCHEMBL5473245 0.86 NQO2 (0.54) NQO2CYP19A1KDM4EALDH1A1HPGD
SCHEMBL12047200 0.82 CTSV (0.68) NQO2KDM4EALDH1A1HPGDTNKS2
SCHEMBL30081022 0.81 KDM4E (0.54) NQO2CYP19A1KDM4EALDH1A1HPGD
SCHEMBL28314220 0.81 KDM4E (0.54) NQO2CYP19A1KDM4EALDH1A1HPGD
SCHEMBL31365388 0.81 KDM4E (0.50) NQO2CYP19A1KDM4EALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11731960-B2 Biheterocyclic compound Sumitomo Pharma Co., Ltd. (JP) 2023-08-22 US disclosed
US-20220380353-A1 BIHETEROCYCLIC COMPOUND Sumitomo Pharma Co., Ltd. (JP) 2022-12-01 US disclosed
WO-2022091048-A1 ECTONUCLEOTIDE PYROPHOSPHATASE-PHOSPHODIESTERASE-1 (ENPP1) INHIBITORS AND USES THEREOF INTEGRAL BIOSCIENCES PRIVATE LIMITED (IN) 2022-05-05 WO disclosed
US-20210198242-A1 BIHETEROCYCLIC COMPOUND SUMITOMO DAINIPPON PHARMA CO., LTD. (JP) 2021-07-01 US disclosed
US-10870642-B2 Biheterocyclic compound SUMITOMO DAINIPPON PHARMA CO., LTD. (JP) 2020-12-22 US disclosed
US-20190308958-A1 BIHETEROCYCLIC COMPOUND SUMITOMO DAINIPPON PHARMA CO., LTD. (JP) 2019-10-10 US disclosed
US-10323024-B2 Biheterocyclic compound SUMITOMO DAINIPPON PHARMA CO., LTD. (JP) 2019-06-18 US disclosed
US-20190016711-A1 BIHETEROCYCLIC COMPOUND SUMITOMO DAINIPPON PHARMA CO., LTD. (JP) 2019-01-17 US disclosed
WO-2017122722-A1 BIHETEROCYCLIC COMPOUND 大日本住友製薬株式会社 2017-07-20 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 (7 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-20220380353-A1 BIHETEROCYCLIC COMPOUND NPY4R, NR4A3, OGFR NQO2 2073/4885CYP19A1 434/4885KDM4E 883/4885
US-11731960-B2 Biheterocyclic compound NR4A3, NGF, OGFR NQO2 2217/4885CYP19A1 450/4885KDM4E 1008/4885
US-20210198242-A1 BIHETEROCYCLIC COMPOUND NR4A3, NGF, OGFR NQO2 2217/4885CYP19A1 450/4885KDM4E 1008/4885
US-20190308958-A1 BIHETEROCYCLIC COMPOUND NR4A3, NGF, OGFR NQO2 2217/4885CYP19A1 450/4885KDM4E 1008/4885
US-10323024-B2 Biheterocyclic compound NR4A3, NGF, OGFR NQO2 2217/4885CYP19A1 450/4885KDM4E 1008/4885
US-10870642-B2 Biheterocyclic compound NR4A3, NGF, OGFR NQO2 2217/4885CYP19A1 450/4885KDM4E 1008/4885
US-20190016711-A1 BIHETEROCYCLIC COMPOUND NR4A3, NGF, OGFR NQO2 2217/4885CYP19A1 450/4885KDM4E 1008/4885

“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.