SCHEMBL17594366

SCHEMBL17594366

O=C1C(Oc2ccc(O)cc2)=C(Oc2ccc(O)cc2)C(=O)c2ccccc21

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LTA4H P09960 2/20 0.56
▸ NR1H2 P55055 1/20 0.56
▸ BAX Q07812 1/20 0.56
▸ NSD2 O96028 1/20 0.53
▸ HSP90AA1 P07900 1/20 0.53
▸ HKDC1 Q2TB90 1/20 0.53
▸ TLR9 Q9NR96 1/20 0.53
▸ MEN1 O00255 3/20 0.52
▸ KMT2A Q03164 3/20 0.52
▸ ESR1 P03372 1/20 0.52
▸ ESR2 Q92731 1/20 0.52
▸ MAPT P10636 4/20 0.49
▸ KDM4E B2RXH2 2/20 0.49
▸ ALDH1A1 P00352 2/20 0.49
▸ LMNA P02545 2/20 0.49
▸ POLB P06746 2/20 0.49
▸ HPGD P15428 2/20 0.49
▸ TDP1 Q9NUW8 2/20 0.49
▸ MAPK1 P28482 2/20 0.49
▸ MITF O75030 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
SCHEMBL1802680 0.82 NSD2 (0.73) LTA4HNSD2HSP90AA1HKDC1TLR9
Anthraquinone SCHEMBL10924432 0.79 MEN1 (0.71) MEN1KMT2AESR1ESR2MAPT
SCHEMBL1242099 0.79 CES2 (0.64) NSD2HSP90AA1HKDC1TLR9MEN1
SCHEMBL19409308 0.79 MAOA (0.56) NSD2HSP90AA1HKDC1TLR9MEN1
SCHEMBL17594549 0.79 CES2 (0.64) NSD2HSP90AA1HKDC1TLR9MEN1
SCHEMBL17594373 0.79 CES2 (0.64) LTA4HNSD2HSP90AA1HKDC1TLR9
SCHEMBL17594484 0.78 GAPDH (0.75) LTA4HNR1H2BAXMAPTTDP1
SCHEMBL11855727 0.77 ADORA2A (0.51) LTA4HNR1H2BAXMEN1KMT2A
SCHEMBL1802867 0.76 ALDH1A1 (0.50) NSD2HSP90AA1HKDC1TLR9KMT2A
SCHEMBL12767607 0.76 NSD2 (0.55) NSD2HSP90AA1HKDC1TLR9MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10577315-B2 Compositions and methods for treatment of prostate carcinoma PELLFICURE PHARMACEUTICALS, INC. (US) 2020-03-03 — — US disclosed
US-10577315-B2 Compositions and methods for treatment of prostate carcinoma PELLFICURE PHARMACEUTICALS, INC. (US) 2020-03-03 — — US disclosed
US-20190169122-A1 COMPOSITIONS AND METHODS FOR TREATMENT OF PROSTATE CARCINOMA PELLFICURE PHARMACEUTICALS 2019-06-06 — — US disclosed
US-20190169122-A1 COMPOSITIONS AND METHODS FOR TREATMENT OF PROSTATE CARCINOMA PELLFICURE PHARMACEUTICALS 2019-06-06 — — US disclosed
US-10093620-B2 Compositions and methods for treatment of prostate carcinoma PELLFICURE PHARMACEUTICALS, INC. (US) 2018-10-09 — — US disclosed
US-20170283374-A1 COMPOSITIONS AND METHODS FOR TREATMENT OF PROSTATE CARCINOMA PELLFICURE PHARMACEUTICALS, INC. 2017-10-05 — — US disclosed
US-20170283374-A1 COMPOSITIONS AND METHODS FOR TREATMENT OF PROSTATE CARCINOMA PELLFICURE PHARMACEUTICALS, INC. 2017-10-05 — — US disclosed
US-20170283374-A1 COMPOSITIONS AND METHODS FOR TREATMENT OF PROSTATE CARCINOMA PELLFICURE PHARMACEUTICALS, INC. 2017-10-05 — — US disclosed
EP-3191087-A1 COMPOSITIONS AND METHODS FOR TREATMENT OF PROSTATE CARCINOMA Pellficure Pharmaceuticals, Inc. (US) 2017-07-19 — — EP disclosed
WO-2016040896-A1 COMPOSITIONS AND METHODS FOR TREATMENT OF PROSTATE CARCINOMA PELLFICURE PHARMACEUTICALS, INC. (US) 2016-03-17 — — 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 (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-10093620-B2 Compositions and methods for treatment of prostate carcinoma KLK3, ACP3, NR5A1 LTA4H 757/4885NR1H2 300/4885BAX 3440/4885
US-20190169122-A1 COMPOSITIONS AND METHODS FOR TREATMENT OF PROSTATE CARCINOMA KLK3, ACP3, NR5A1 LTA4H 757/4885NR1H2 300/4885BAX 3440/4885
US-20170283374-A1 COMPOSITIONS AND METHODS FOR TREATMENT OF PROSTATE CARCINOMA KLK3, ACP3, NR5A1 LTA4H 757/4885NR1H2 300/4885BAX 3440/4885
US-10577315-B2 Compositions and methods for treatment of prostate carcinoma KLK3, ACP3, NR5A1 LTA4H 757/4885NR1H2 300/4885BAX 3440/4885

“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.

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