SCHEMBL6706507

SCHEMBL6706507

COC(=O)c1cccc(C(F)(F)F)c1Cl

nearest known ligand 0.56

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CTSS P25774 4/20 0.56
PDK2 Q15119 3/20 0.55
PDK1 Q15118 1/20 0.55
PDK3 Q15120 1/20 0.55
PDK4 Q16654 1/20 0.55
CTSK P43235 3/20 0.53
P2RX7 Q99572 9/20 0.48
LMNA P02545 2/20 0.45
GAA P10253 1/20 0.45
TSHR P16473 1/20 0.44
CFTR P13569 1/20 0.44
SLC6A4 P31645 1/20 0.44
SLC6A3 Q01959 1/20 0.44

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
SCHEMBL27941733 0.84 ALDH1A1 (0.47) CTSSPDK2PDK1PDK3PDK4
SCHEMBL45490 0.82 LMNA (0.59) PDK2LMNAGAATSHRCFTR
SCHEMBL1508457 0.81 LMNA (0.50) CTSSPDK2PDK1PDK3PDK4
SCHEMBL5239843 0.81 CTSS (0.51) CTSSPDK2LMNAGAATSHR
SCHEMBL726068 0.81 TAS2R14 (0.54) CTSSPDK2PDK1PDK3PDK4
SCHEMBL9524633 0.81 CTSS (0.56) CTSSCTSKP2RX7LMNAGAA
SCHEMBL30562236 0.81 CTSS (0.56) CTSSCTSKP2RX7LMNAGAA
SCHEMBL28311763 0.80 CTSS (0.55) CTSSCTSKP2RX7LMNAGAA
SCHEMBL20267168 0.80 ALDH1A1 (0.57) CTSSPDK2CTSKP2RX7LMNA
SCHEMBL7984064 0.80 CTSS (0.63) CTSSPDK2CTSKP2RX7LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10851072-B2 Inhibitors of Rho/MRTF/SRF-mediated gene transcription and methods for use of the same THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2020-12-01 US disclosed
US-10851072-B2 Inhibitors of Rho/MRTF/SRF-mediated gene transcription and methods for use of the same THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2020-12-01 US disclosed
US-20190308947-A1 INHIBITORS OF RHO/MRTF/SRF-MEDIATED GENE TRANSCRIPTION AND METHODS FOR USE OF THE SAME THE REGENTS OF THE UNIVERSITY OF MICHIGAN 2019-10-10 US disclosed
US-20190308947-A1 INHIBITORS OF RHO/MRTF/SRF-MEDIATED GENE TRANSCRIPTION AND METHODS FOR USE OF THE SAME THE REGENTS OF THE UNIVERSITY OF MICHIGAN 2019-10-10 US disclosed
WO-2019195641-A2 INHIBITORS OF RHO/MRTF/SRF-MEDIATED GENE TRANSCRIPTION AND METHODS FOR USE OF THE SAME THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2019-10-10 WO disclosed
WO-2019195641-A2 INHIBITORS OF RHO/MRTF/SRF-MEDIATED GENE TRANSCRIPTION AND METHODS FOR USE OF THE SAME THE REGENTS OF THE UNIVERSITY OF MICHIGAN (US) 2019-10-10 WO disclosed
CN-106543143-B A kind of novel FLT3 kinase inhibitor and application thereof 合肥中科普瑞昇生物医药科技有限公司 2019-03-22 CN disclosed
US-20040024215-A1 Benzamide derivatives and their use as apob-100 and mtp inhibitors SMITHKLINE BEECHAM CORPORATION 2004-02-05 US disclosed
WO-2003048121-A1 THERAPEUTIC BENZAMIDE DERIVATIVES GLAXO GROUP LIMITED (GB) 2003-06-12 WO disclosed
EP-1289971-A1 BENZAMIDE DERIVATIVES AND THEIR USE AS APOB-100 AND MTP INHIBITORS GLAXO GROUP LIMITED (GB) 2003-03-12 EP disclosed
WO-2001092241-A1 BENZAMIDE DERIVATIVES AND THEIR USE AS APOB-100 AND MTP INHIBITORS GLAXO GROUP LIMITED (GB) 2001-12-06 WO disclosed
CN-1137035-A Basic group substituted benzoyl guanidine, its preparing process, its use as medicine or diagnostic reagent, and medicine containing the same HOECHST AG (DE) 1996-12-04 CN 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 (3 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-20040024215-A1 Benzamide derivatives and their use as apob-100 and mtp inhibitors APOB, APOL1, CETP CTSS 701/4885PDK2 4600/4885PDK1 4107/4885
US-20190308947-A1 INHIBITORS OF RHO/MRTF/SRF-MEDIATED GENE TRANSCRIPTION AND METHODS FOR USE OF THE SAME RHOXF2, BPTF, SREBF1 CTSS 3355/4885PDK2 3223/4885PDK1 2930/4885
US-10851072-B2 Inhibitors of Rho/MRTF/SRF-mediated gene transcription and methods for use of the same RHOXF2, BPTF, SREBF1 CTSS 3355/4885PDK2 3223/4885PDK1 2930/4885

“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.