SCHEMBL19556007

SCHEMBL19556007

CCOC(=O)c1cnc(C2=CCC(F)(F)CC2)o1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NLRP3 Q96P20 1/20 0.41
▸ HDAC4 P56524 1/20 0.39
▸ HDAC6 Q9UBN7 1/20 0.39
▸ L3MBTL1 Q9Y468 2/20 0.35
▸ NPC1 O15118 2/20 0.35
▸ RAB9A P51151 2/20 0.35
▸ ALDH1A1 P00352 8/20 0.33
▸ TBK1 Q9UHD2 1/20 0.33
▸ GAA P10253 4/20 0.33
▸ TSHR P16473 2/20 0.32
▸ AKR1B1 P15121 1/20 0.32
▸ TP53 P04637 2/20 0.32
▸ CYP2C19 P33261 2/20 0.32
▸ CYP2D6 P10635 1/20 0.32
▸ HSD17B10 Q99714 3/20 0.32
▸ KDM4E B2RXH2 3/20 0.32
▸ POLB P06746 2/20 0.32
▸ MAPT P10636 2/20 0.32
▸ TLR2 O60603 1/20 0.32
▸ NSD2 O96028 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
SCHEMBL19556453 0.77 NLRP3 (0.43) NLRP3HDAC4HDAC6L3MBTL1NPC1
SCHEMBL19556316 0.75 NLRP3 (0.42) NLRP3HDAC4HDAC6L3MBTL1NPC1
SCHEMBL22437148 0.75 NLRP3 (0.42) NLRP3HDAC4HDAC6L3MBTL1NPC1
SCHEMBL24213929 0.74 CA12 (0.46) L3MBTL1NPC1RAB9AALDH1A1CYP2C19
SCHEMBL21678923 0.73 NLRP3 (0.40) NLRP3HDAC4HDAC6L3MBTL1NPC1
SCHEMBL19556078 0.73 NLRP3 (0.40) NLRP3HDAC4HDAC6MAPTJAK2
SCHEMBL31706099 0.71 NLRP3 (0.39) NLRP3HDAC4HDAC6L3MBTL1NPC1
SCHEMBL31440852 0.71 KDM4E (0.36) L3MBTL1NPC1RAB9AALDH1A1GAA
SCHEMBL19556335 0.70 HDAC4 (0.43) NLRP3HDAC4HDAC6L3MBTL1NPC1
SCHEMBL21679172 0.70 NLRP3 (0.40) NLRP3HDAC4HDAC6L3MBTL1NPC1

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
EP-3710428-B1 MODULATORS OF THE INTEGRATED STRESS PATHWAY CALICO LIFE SCIENCES LLC (US) 2026-03-25 — — EP disclosed
US-20240307382-A1 MODULATORS OF THE INTEGRATED STRESS PATHWAY ABBVIE INC. 2024-09-19 — — US disclosed
CN-112204009-B Modulators of integrated stress pathways 卡里科生命科学有限责任公司 2024-05-07 — — CN disclosed
EP-3452456-B1 BICYCLIC MODULATORS OF THE INTEGRATED STRESS PATHWAY CALICO LIFE SCIENCES LLC (US) 2023-07-05 — — EP disclosed
US-20220106281-A1 MODULATORS OF THE INTEGRATED STRESS PATHWAY CALICO LIFE SCIENCES LLC (US) 2022-04-07 — — US disclosed
US-10913727-B2 Modulators of the integrated stress pathway ABBVIE INC. (US) 2021-02-09 — — US disclosed
CN-112204009-A Modulators of integrated stress pathways 卡里科生命科学有限责任公司 2021-01-08 — — CN disclosed
US-20200345727-A1 MODULATORS OF THE INTEGRATED STRESS PATHWAY ABBVIE INC. 2020-11-05 — — US disclosed
EP-3710428-A1 MODULATORS OF THE INTEGRATED STRESS PATHWAY Calico Life Sciences LLC (US) 2020-09-23 — — EP disclosed
US-20190135772-A1 MODULATORS OF THE INTEGRATED STRESS PATHWAY ABBVIE INC. 2019-05-09 — — US disclosed
EP-3452456-A1 MODULATORS OF THE INTEGRATED STRESS PATHWAY Calico Life Sciences LLC (US) 2019-03-13 — — EP disclosed
WO-2017193063-A1 MODULATORS OF THE INTEGRATED STRESS PATHWAY CALICO LIFE SCIENCES (US) 2017-11-09 — — 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 (5 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-10913727-B2 Modulators of the integrated stress pathway ATF4, ATF1, DDIT3 NLRP3 1387/4885HDAC4 533/4885HDAC6 437/4885
US-20240307382-A1 MODULATORS OF THE INTEGRATED STRESS PATHWAY ATF4, ATF1, DDIT3 NLRP3 1387/4885HDAC4 533/4885HDAC6 437/4885
US-20220106281-A1 MODULATORS OF THE INTEGRATED STRESS PATHWAY ATF4, ATF1, DDIT3 NLRP3 1387/4885HDAC4 533/4885HDAC6 437/4885
US-20190135772-A1 MODULATORS OF THE INTEGRATED STRESS PATHWAY ATF4, ATF1, DDIT3 NLRP3 1387/4885HDAC4 533/4885HDAC6 437/4885
US-20200345727-A1 MODULATORS OF THE INTEGRATED STRESS PATHWAY ATF4, ATF1, DDIT3 NLRP3 1387/4885HDAC4 533/4885HDAC6 437/4885

“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.

Send feedback