SCHEMBL16749262

SCHEMBL16749262

O=C(O)CC1CC(F)(F)CN1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ITGB3 P05106 1/20 0.39
ITGB2 P05107 1/20 0.39
ITGB1 P05556 1/20 0.39
ITGAV P06756 1/20 0.39
ITGA2B P08514 1/20 0.39
ITGA5 P08648 1/20 0.39
ITGB5 P18084 1/20 0.39
ITGAL P20701 1/20 0.39
SLC6A12 P48065 6/20 0.36
SLC6A11 P48066 6/20 0.36
SLC6A13 Q9NSD5 5/20 0.36
SLC6A1 P30531 4/20 0.36
GABRA5 P31644 4/20 0.36
GABRB2 P47870 4/20 0.36
GABRA1 P14867 3/20 0.36
GABRR1 P24046 3/20 0.36
GABRA4 P48169 3/20 0.36
GRM2 Q14416 2/20 0.34
GRM5 P41594 1/20 0.34
GRM1 Q13255 1/20 0.34

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
SCHEMBL23723154 1.00 ITGB3 (0.39) ITGB3ITGB2ITGB1ITGAVITGA2B
Hydrochloric Acid SCHEMBL17924757 0.98 ITGB3 (0.38) ITGB3ITGB2ITGB1ITGAVITGA2B
SCHEMBL16749338 0.81
SCHEMBL18721171 0.81
Hydrochloric Acid SCHEMBL17924744 0.79
Hydrochloric Acid SCHEMBL17924726 0.79
SCHEMBL18826932 0.78 ALOX5 (0.34) CYP2C9MEN1KMT2A
SCHEMBL21111223 0.77 PTGIR (0.33)
SCHEMBL17933284 0.77 LMNA (0.37) CYP2C9MEN1KMT2A
SCHEMBL23723008 0.76 ITGB3 (0.39) ITGB3ITGB2ITGB1ITGAVITGA2B

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-20250388604-A1 Compounds and Their Use as PDE4 Activators MIRONID LIMITED (GB) 2025-12-25 US disclosed
EP-4572762-A1 COMPOUNDS AND THEIR USE AS PDE4 ACTIVATORS Mironid Limited (GB) 2025-06-25 EP disclosed
WO-2025072539-A1 AMINO ACID COMPOUNDS WITH NITROGEN LINKERS AND USES THEREOF PLIANT THERAPEUTICS, INC. (US) 2025-04-03 WO disclosed
WO-2024038128-A1 COMPOUNDS AND THEIR USE AS PDE4 ACTIVATORS MIRONID LIMITED (GB) 2024-02-22 WO disclosed
EP-3071564-B1 DIHYDROPYRIMIDINE COMPOUNDS AND THEIR APPLICATION IN PHARMACEUTICALS SUNSHINE LAKE PHARMA CO LTD (CN) 2020-08-05 EP disclosed
US-9498479-B2 Dihydropyrimidine compounds and their application in pharmaceuticals SUNSHINE LAKE PHARMA CO., LTD. (CN) 2016-11-22 US disclosed
US-9498479-B2 Dihydropyrimidine compounds and their application in pharmaceuticals SUNSHINE LAKE PHARMA CO., LTD. (CN) 2016-11-22 US disclosed
US-20160206616-A1 DIHYDROPYRIMIDINE COMPOUNDS AND THEIR APPLICATION IN PHARMACEUTICALS SUNSHINE LAKE PHARMA CO., LTD. (CN) 2016-07-21 US disclosed
US-20160206616-A1 DIHYDROPYRIMIDINE COMPOUNDS AND THEIR APPLICATION IN PHARMACEUTICALS SUNSHINE LAKE PHARMA CO., LTD. (CN) 2016-07-21 US disclosed
WO-2015074546-A1 DIHYDROPYRIMIDINE COMPOUNDS AND THEIR APPLICATION IN PHARMACEUTICALS SUNSHINE LAKE PHARMA CO., LTD. (CN) 2015-05-28 WO disclosed
CN-103153993-A Apoptosis-inducing agents for the treatment of cancer and immune and autoimmune diseases ABBOTT LAB 2013-06-12 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 (2 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-20250388604-A1 Compounds and Their Use as PDE4 Activators PDE4A, PDE7A, PDE4B ITGB3 2718/4885ITGB2 3086/4885ITGB1 3192/4885
US-20160206616-A1 DIHYDROPYRIMIDINE COMPOUNDS AND THEIR APPLICATION IN PHARMACEUTICALS DPYD, SLC10A1, HPRT1 ITGB3 4871/4885ITGB2 4855/4885ITGB1 4811/4885

“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.