SCHEMBL15828699

SCHEMBL15828699

COc1cc(C(C)(C)C)cc(C)c1C

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.43
HTR1D P28221 2/20 0.38
CYP3A4 P08684 2/20 0.37
LMNA P02545 1/20 0.36
TP53 P04637 1/20 0.36
HPGD P15428 1/20 0.36
ALOX15 P16050 1/20 0.36
GABRA1 P14867 1/20 0.36
GABRB2 P47870 1/20 0.36
ALDH1A1 P00352 2/20 0.35
ACHE P22303 2/20 0.34
HTR1B P28222 1/20 0.34
TUBB1 Q9H4B7 2/20 0.34
KDM4E B2RXH2 1/20 0.33
KMT2A Q03164 2/20 0.33
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA9 Q16790 1/20 0.32
MEN1 O00255 1/20 0.32
RXFP1 Q9HBX9 1/20 0.32

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
SCHEMBL13021639 0.91 POLB (0.41) POLBHTR1DCYP3A4LMNATP53
SCHEMBL19803239 0.81 TUBB1 (0.35) POLBHTR1DCYP3A4LMNATP53
SCHEMBL13558892 0.81 HIF1A (0.39) POLBCYP3A4LMNATP53HPGD
SCHEMBL26778024 0.80 POLB (0.41) POLBHTR1DCYP3A4LMNATP53
SCHEMBL12024914 0.80 ACHE (0.48) POLBHTR1DCYP3A4LMNATP53
SCHEMBL10015238 0.78 EGFR (0.45) POLBHTR1DCYP3A4LMNATP53
SCHEMBL16302410 0.78 POLB (0.40) POLBHTR1DCYP3A4LMNATP53
SCHEMBL27587653 0.78 POLB (0.61) POLBHTR1DCYP3A4LMNATP53
SCHEMBL8664743 0.77 POLB (0.57) POLBHTR1DLMNATP53HPGD
SCHEMBL10212113 0.76 TP53 (0.39) POLBCYP3A4LMNATP53HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3596140-B1 PROCESS FOR PREPARING A PROCATALYST FOR POLYMERIZATION OF OLEFINS SABIC GLOBAL TECHNOLOGIES BV (NL) 2024-03-20 EP disclosed
US-11760715-B2 Modulators of lipoxygenase and cyclooxygenase enzyme activity UNIVERSITÉ DE MONCTON (CA) 2023-09-19 US disclosed
US-20230219942-A1 COMPOUNDS COMPRISING A THREE RING CORE AS PD-1/PD-L1 BLOCKERS RELIVE THERAPEUTICS INC. (CA) 2023-07-13 US disclosed
US-20170362180-A1 QUINOLONE COMPOUND OTSUKA PHARMA CO LTD (JP) 2017-12-21 US disclosed
US-20170050922-A2 HDAC8 INHIBITORS FOR TREATING CANCER CITY OF HOPE 2017-02-23 US disclosed
US-20160340314-A1 QUINOLONE COMPOUND OTSUKA PHARMA CO LTD (JP) 2016-11-24 US disclosed
US-9440951-B2 Quinolone compound OTSUKA PHARMACEUTICAL CO., LTD (JP) 2016-09-13 US disclosed
US-20150239865-A1 QUINOLONE COMPOUND OTSUKA PHARMA CO LTD (JP) 2015-08-27 US disclosed
US-9067887-B2 Quinolone compound OTSUKA PHARMACEUTICAL CO., LTD (JP) 2015-06-30 US disclosed
US-20150005287-A2 QUINOLONE COMPOUND OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2015-01-01 US disclosed
US-20140179675-A1 QUINOLONE COMPOUND OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2014-06-26 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 (8 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-20150239865-A1 QUINOLONE COMPOUND HAX1, NQO2, NHERF1 POLB 1124/4885HTR1D 639/4885CYP3A4 192/4885
US-20170362180-A1 QUINOLONE COMPOUND HAX1, NQO2, NHERF1 POLB 1124/4885HTR1D 639/4885CYP3A4 192/4885
US-20170050922-A2 HDAC8 INHIBITORS FOR TREATING CANCER HDAC8, HDAC1, HDAC7 POLB 2428/4885HTR1D 4306/4885CYP3A4 4533/4885
US-20160340314-A1 QUINOLONE COMPOUND HAX1, NQO2, NHERF1 POLB 1124/4885HTR1D 639/4885CYP3A4 192/4885
US-11760715-B2 Modulators of lipoxygenase and cyclooxygenase enzyme activity ALOX12, ALOX15B, ALOX5 POLB 2259/4885HTR1D 1372/4885CYP3A4 410/4885
US-20150005287-A2 QUINOLONE COMPOUND HAX1, NQO2, VIP POLB 1272/4885HTR1D 731/4885CYP3A4 219/4885
US-20140179675-A1 QUINOLONE COMPOUND HAX1, NQO2, NHERF1 POLB 1124/4885HTR1D 639/4885CYP3A4 192/4885
US-20230219942-A1 COMPOUNDS COMPRISING A THREE RING CORE AS PD-1/PD-L1 BLOCKERS CD274, PDCD1, PDCD1LG2 POLB 646/4885HTR1D 2236/4885CYP3A4 1942/4885

“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.