SCHEMBL138188

SCHEMBL138188

COc1cc(C=O)cc(OC)c1OC(F)F

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 8/20 0.48
TSHR P16473 2/20 0.48
HPGD P15428 2/20 0.44
TDP1 Q9NUW8 2/20 0.44
TRIM24 O15164 1/20 0.44
ALDH5A1 P51649 1/20 0.44
ABAT P80404 1/20 0.44
TRIM33 Q9UPN9 1/20 0.44
MAPK1 P28482 1/20 0.43
FDPS P14324 1/20 0.42
KMT2A Q03164 1/20 0.41
DRD1 P21728 2/20 0.41
AOX1 Q06278 1/20 0.41
KDM4E B2RXH2 3/20 0.40
HTT P42858 2/20 0.40
PDE4B Q07343 1/20 0.40
TTR P02766 1/20 0.39
GAA P10253 1/20 0.39
HTR1A P08908 1/20 0.39
HTR2C P28335 1/20 0.39

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
SCHEMBL7842122 0.83 ALDH1A1 (0.50) ALDH1A1TSHRHPGDTDP1TRIM24
SCHEMBL10959952 0.81 ALDH1A1 (0.48) ALDH1A1TSHRHPGDTDP1TRIM24
SCHEMBL3112001 0.80 ALDH1A1 (0.47) ALDH1A1TSHRHPGDTDP1TRIM24
SCHEMBL7832025 0.80 ALDH1A1 (0.47) ALDH1A1TSHRHPGDTDP1TRIM24
SCHEMBL16619850 0.80 ALDH1A1 (0.59) ALDH1A1TSHRHPGDTDP1TRIM24
SCHEMBL96635 0.80 ALDH1A1 (0.59) ALDH1A1TSHRHPGDTDP1TRIM24
SCHEMBL13243772 0.79 ALDH1A1 (0.46) ALDH1A1TSHRHPGDTDP1TRIM24
SCHEMBL1966450 0.79 ALDH1A1 (0.70) ALDH1A1TSHRHPGDTDP1TRIM24
SCHEMBL140472 0.79 ALDH1A1 (0.70) ALDH1A1TSHRHPGDTDP1TRIM24
Hydrochloric Acid SCHEMBL23711567 0.78 ALDH1A1 (0.57) ALDH1A1TSHRHPGDTDP1TRIM24

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107162928-B Halogenated analogs of anti-fibrotic agents 塞尔塔医疗有限公司 2022-03-11 CN disclosed
EP-3045170-B1 HALOGENATED ANALOGUES OF ANTI-FIBROTIC AGENTS FIBROTECH THERAPEUTICS PTY LTD (AU) 2018-07-04 EP disclosed
CN-107162928-A The halogenated analogues of antifibrotic agents 法博太科制药有限公司 2017-09-15 CN disclosed
EP-3045170-A1 HALOGENATED ANALOGUES OF ANTI-FIBROTIC AGENTS Fibrotech Therapeutics PTY LTD (AU) 2016-07-20 EP disclosed
EP-3045170-A1 HALOGENATED ANALOGUES OF ANTI-FIBROTIC AGENTS Fibrotech Therapeutics PTY LTD (AU) 2016-07-20 EP disclosed
EP-2220028-B1 HALOGENATED ANALOGUES OF ANTI-FIBROTIC AGENTS FIBROTECH THERAPEUTICS PTY LTD (AU) 2016-03-09 EP disclosed
EP-2220028-B1 HALOGENATED ANALOGUES OF ANTI-FIBROTIC AGENTS FIBROTECH THERAPEUTICS PTY LTD (AU) 2016-03-09 EP disclosed
US-20150336866-A1 SYNTHESIS OF DIFLUOROMETHYL ETHERS AND SULFIDES THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2015-11-26 US disclosed
US-20150336866-A1 SYNTHESIS OF DIFLUOROMETHYL ETHERS AND SULFIDES THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2015-11-26 US disclosed
US-20150336866-A1 SYNTHESIS OF DIFLUOROMETHYL ETHERS AND SULFIDES THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2015-11-26 US disclosed
WO-2014107380-A1 SYNTHESIS OF DIFLUOROMETHYL ETHERS AND SULFIDES THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2014-07-10 WO disclosed
WO-2014107380-A1 SYNTHESIS OF DIFLUOROMETHYL ETHERS AND SULFIDES THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2014-07-10 WO disclosed
US-8624056-B2 Halogenated analogues of anti-fibrotic agents FIBROTECH THERAPEUTICS PTY LTD 2014-01-07 US disclosed
US-8624056-B2 Halogenated analogues of anti-fibrotic agents FIBROTECH THERAPEUTICS PTY LTD 2014-01-07 US disclosed
US-20120059188-A9 HALOGENATED ANALOGUES OF ANTI-FIBROTIC AGENTS THE UNIVERSITY OF MELBOURNE (AU) 2012-03-08 US disclosed
CN-102164887-A Halogenated analogs of anti-fibrotic agents FIBROTECH THERAPEUTICS PTY LTD 2011-08-24 CN disclosed
US-20110021815-A1 HALOGENATED ANALOGUES OF ANTI-FIBROTIC AGENTS FIBROTECH THERAPEUTICS PTY LTD (AU) 2011-01-27 US disclosed
EP-2220028-A1 HALOGENATED ANALOGUES OF ANTI-FIBROTIC AGENTS Fibrotech Therapeutics PTY LTD (AU) 2010-08-25 EP disclosed
WO-2009079692-A1 HALOGENATED ANALOGUES OF ANTI-FIBROTIC AGENTS FIBROTECH THERAPEUTICS PTY LTD (AU) 2009-07-02 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 (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-20150336866-A1 SYNTHESIS OF DIFLUOROMETHYL ETHERS AND SULFIDES DDT, ABL1, TYR ALDH1A1 3454/4885TSHR 784/4885HPGD 3936/4885
US-20120059188-A9 HALOGENATED ANALOGUES OF ANTI-FIBROTIC AGENTS MMP1, FIBP, HDGF ALDH1A1 242/4885TSHR 1427/4885HPGD 1175/4885
US-20110021815-A1 HALOGENATED ANALOGUES OF ANTI-FIBROTIC AGENTS MMP1, FIBP, HDGF ALDH1A1 242/4885TSHR 1427/4885HPGD 1175/4885

“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.