SCHEMBL2769865

SCHEMBL2769865

COC(=O)c1ccc(CO)cc1C(F)(F)F

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 2/20 0.48
CA2 P00918 2/20 0.48
CA7 P43166 2/20 0.48
CA9 Q16790 2/20 0.48
CA14 Q9ULX7 2/20 0.48
CA3 P07451 1/20 0.48
CA6 P23280 1/20 0.48
CA5A P35218 1/20 0.48
CA5B Q9Y2D0 1/20 0.48
CFTR P13569 4/20 0.48
NOTUM Q6P988 2/20 0.44
KDM4E B2RXH2 5/20 0.43
ALDH1A1 P00352 2/20 0.43
HPGD P15428 2/20 0.43
HSD17B10 Q99714 2/20 0.43
MAPT P10636 2/20 0.43
GAA P10253 1/20 0.43
ALOX15 P16050 1/20 0.43
TSHR P16473 1/20 0.43
ESRRA P11474 1/20 0.40

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
SCHEMBL10309762 0.89 CFTR (0.49) CA12CA2CA7CA9CA14
SCHEMBL29244656 0.86 CFTR (0.47) CA12CA2CA7CA9CA14
SCHEMBL29338521 0.86 CFTR (0.50) CA12CA2CA7CA9CA14
SCHEMBL3898889 0.84 CFTR (0.44) CFTRNOTUMKDM4EALDH1A1HPGD
SCHEMBL2495129 0.82 CFTR (0.43) CA12CA2CA7CA9CA14
SCHEMBL20178593 0.82 PPARA (0.46) CFTRNOTUMKDM4EALDH1A1HPGD
SCHEMBL3670006 0.82 CES2 (0.46) CA12CA2CA7CA9CA14
SCHEMBL6477497 0.80 CA12 (0.55) CA12CA2CA7CA9CA14
SCHEMBL2504798 0.80 MLYCD (0.40) GAACES2ESRRGKIF11AR
SCHEMBL29338505 0.79 CFTR (0.41) CA12CA2CA7CA9CA14

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 26 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118239926-A TLR7 and 8 inhibitors, preparation method and application thereof 上海深势唯思科技有限责任公司 2024-06-25 CN disclosed
CN-104177349-A INSECTICIDAL COMPOUNDS SYNGENTA CROP PROTECTION LLC 2014-12-03 CN disclosed
US-20140080877-A1 INSECTICIDAL COMPOUNDS SYNGENTA CROP PROTECTION, LLC (US) 2014-03-20 US disclosed
US-20140080877-A1 INSECTICIDAL COMPOUNDS SYNGENTA CROP PROTECTION, LLC (US) 2014-03-20 US disclosed
US-20140080877-A1 INSECTICIDAL COMPOUNDS SYNGENTA CROP PROTECTION, LLC (US) 2014-03-20 US disclosed
US-8623896-B2 Insecticidal compounds SYNGENTA CROP PROTECTION, LLC (US) 2014-01-07 US disclosed
US-8623896-B2 Insecticidal compounds SYNGENTA CROP PROTECTION, LLC (US) 2014-01-07 US disclosed
US-8623896-B2 Insecticidal compounds SYNGENTA CROP PROTECTION, LLC (US) 2014-01-07 US disclosed
EP-2592079-A2 Insecticidal compounds Syngenta Participations AG. (CH) 2013-05-15 EP disclosed
EP-2592079-A2 Insecticidal compounds Syngenta Participations AG. (CH) 2013-05-15 EP disclosed
US-20100279999-A1 INSECTICIDAL COMPOUNDS SYNGENTA CROP PROTECTION, INC. (US) 2010-11-04 US disclosed
US-20100279999-A1 INSECTICIDAL COMPOUNDS SYNGENTA CROP PROTECTION, INC. (US) 2010-11-04 US disclosed
US-20100279999-A1 INSECTICIDAL COMPOUNDS SYNGENTA CROP PROTECTION, INC. (US) 2010-11-04 US disclosed
EP-2238132-A2 INSECTICIDAL COMPOUNDS Syngenta Participations AG (CH) 2010-10-13 EP disclosed
EP-2029547-B1 FXR AGONISTS LILLY CO ELI (US) 2010-04-28 EP disclosed
US-20090270460-A1 FXR AGONISTS JPMORGAN CHASE BANK, N.A., AS SUCCESSOR COLLATERAL AGENT 2009-10-29 US disclosed
WO-2009080250-A2 INSECTICIDAL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2009-07-02 WO disclosed
WO-2009080250-A2 INSECTICIDAL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2009-07-02 WO disclosed
EP-2029547-A1 FXR AGONISTS ELI LILLY AND COMPANY (US) 2009-03-04 EP disclosed
WO-2007140183-A1 FXR AGONISTS ELI LILLY AND COMPANY (US) 2007-12-06 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-20090270460-A1 FXR AGONISTS NR1H4, SLC10A1, GPBAR1 CA12 4483/4885CA2 4145/4885CA7 4161/4885
US-20100279999-A1 INSECTICIDAL COMPOUNDS CHRM1, ACHE, CHRM2 CA12 2615/4885CA2 91/4885CA7 833/4885
US-20140080877-A1 INSECTICIDAL COMPOUNDS CHRM1, ACHE, CHRM2 CA12 2667/4885CA2 96/4885CA7 836/4885

“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.