SCHEMBL26523712

SCHEMBL26523712

Oc1c(F)ccc(C(F)(F)F)c1F

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KIF11 P52732 9/20 0.44
ERN1 O75460 1/20 0.34
PDE2A O00408 1/20 0.33
KDM1A O60341 1/20 0.32
CES2 O00748 1/20 0.32
PTPN7 P35236 1/20 0.32
DUSP3 P51452 1/20 0.32
TMPRSS4 Q9NRS4 1/20 0.32
MEP1A Q16819 1/20 0.32
MEP1B Q16820 1/20 0.32
EPHX2 P34913 1/20 0.31
CA3 P07451 1/20 0.31
CA6 P23280 1/20 0.31
CA5A P35218 1/20 0.31
CA9 Q16790 1/20 0.31
CA14 Q9ULX7 1/20 0.31
CA5B Q9Y2D0 1/20 0.31

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
SCHEMBL29490962 1.00 KIF11 (0.44) KIF11ERN1PDE2AKDM1ACES2
SCHEMBL12974456 0.79 CA2 (0.44) ERN1
SCHEMBL5594767 0.77 KIF11 (0.37) KIF11PDE2AKDM1A
SCHEMBL20165547 0.77 KIF11 (0.37) KIF11PDE2ACES2TMPRSS4
SCHEMBL19865216 0.77 KIF11 (0.41) KIF11ERN1KDM1ACES2PTPN7
SCHEMBL102339 0.77 KIF11 (0.41) KIF11ERN1KDM1A
SCHEMBL4346966 0.77 KIF11 (0.41) KIF11TMPRSS4
SCHEMBL30524326 0.77 PDE2A (0.40) KIF11PDE2AKDM1ACES2
SCHEMBL8160495 0.77 PDE2A (0.40) KIF11PDE2AKDM1ACES2
SCHEMBL28453327 0.76 PDE2A (0.45) KIF11PDE2AKDM1ACES2

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
US-20240368127-A1 HSD17B13 INHIBITORS AND USES THEREOF FL2022-001, INC. 2024-11-07 US disclosed
US-20240083861-A1 HSD17B13 INHIBITORS AND USES THEREOF FL2022-001, INC. 2024-03-14 US disclosed
US-20240034736-A1 HSD17B13 INHIBITORS AND USES THEREOF FL2022-001, INC. 2024-02-01 US disclosed
WO-2023192375-A1 HSD17B13 INHIBITORS AND USES THEREOF FL2022-001, INC. (US) 2023-10-05 WO disclosed
WO-2023192375-A1 HSD17B13 INHIBITORS AND USES THEREOF FL2022-001, INC. (US) 2023-10-05 WO disclosed
CN-116744918-A HSD17B13 inhibitors and uses thereof FL2022-001公司 2023-09-12 CN disclosed
EP-4221702-A1 HSD17B13 INHIBITORS AND USES THEREOF FL2022-001, Inc. (US) 2023-08-09 EP disclosed
EP-4221703-A1 HSD17B13 INHIBITORS AND USES THEREOF FL2022-001, Inc. (US) 2023-08-09 EP disclosed
WO-2023043836-A1 HSD17B13 INHIBITORS AND USES THEREOF METACRINE, INC. (US) 2023-03-23 WO disclosed
WO-2022072512-A1 HSD17B13 INHIBITORS AND USES THEREOF METACRINE, INC. (US) 2022-04-07 WO disclosed
WO-2022072517-A1 HSD17B13 INHIBITORS AND USES THEREOF METACRINE, INC. (US) 2022-04-07 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-20240034736-A1 HSD17B13 INHIBITORS AND USES THEREOF HSD17B3, HSD17B11, HSD17B1 KIF11 4244/4885ERN1 1599/4885PDE2A 931/4885
US-20240083861-A1 HSD17B13 INHIBITORS AND USES THEREOF HSD17B3, HSD17B11, HSD17B1 KIF11 4244/4885ERN1 1599/4885PDE2A 931/4885
US-20240368127-A1 HSD17B13 INHIBITORS AND USES THEREOF HSD17B3, HSD17B11, HSD17B1 KIF11 4244/4885ERN1 1599/4885PDE2A 931/4885

“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.