SCHEMBL20622503

SCHEMBL20622503

CCc1ccc(C(C)C)c(F)c1F

nearest known ligand 0.40

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
EIF4A3 P38919 1/20 0.40
PDE2A O00408 2/20 0.39
ACE2 Q9BYF1 1/20 0.33
FEN1 P39748 1/20 0.32
P2RX7 Q99572 1/20 0.31
GABRA1 P14867 1/20 0.30
GABRG2 P18507 1/20 0.30
GABRB3 P28472 1/20 0.30
ANPEP P15144 1/20 0.30
DPP4 P27487 1/20 0.30

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
SCHEMBL14964461 0.83 EIF4A3 (0.35) EIF4A3PDE2AACE2FEN1
SCHEMBL15417382 0.83 EIF4A3 (0.35) EIF4A3PDE2AACE2FEN1
SCHEMBL20226998 0.82 EIF4A3 (0.34) EIF4A3ACE2P2RX7
SCHEMBL17128822 0.81 ACE2 (0.42) EIF4A3ACE2P2RX7GABRA1GABRG2
SCHEMBL27342163 0.81 CTSS (0.40) EIF4A3FEN1GABRA1
SCHEMBL14132473 0.81 GABRA1 (0.42) EIF4A3GABRA1GABRG2GABRB3ANPEP
SCHEMBL12173269 0.81 EIF4A3 (0.41) EIF4A3PDE2AGABRA1GABRG2GABRB3
SCHEMBL19196278 0.81 GABRA1 (0.39) PDE2AFEN1P2RX7GABRA1
SCHEMBL7762549 0.77 GABRA1 (0.39) PDE2AFEN1GABRA1
SCHEMBL22483857 0.76 EIF4A3 (0.30) EIF4A3ANPEPDPP4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11820757-B2 Antagonists of the muscarinic acetylcholine receptor M4 VANDERBILT UNIVERSITY (US) 2023-11-21 US disclosed
US-20220213069-A1 ANTAGONISTS OF THE MUSCARINIC ACETYLCHOLINE RECEPTOR M4 VANDERBILT UNIVERSITY 2022-07-07 US disclosed
US-11214560-B2 Modulators of P97 AAA ATPase activity University of Pittsburgh—of the Commonwealth System of Higher Education (US) 2022-01-04 US disclosed
EP-3523313-B1 DIBENZO[D,B]SILOLE-BASED REACTIVE MESOGENS LOMOX LTD (GB) 2021-05-05 EP disclosed
US-20200216410-A1 MODULATORS OF P97 AAA ATPASE ACTIVITY UNIVERSITY OF PITTSBURGH-OF THE COMMONWEALTH SYSTEM OF HIGHER EDUCATION (US) 2020-07-09 US disclosed
US-20200155536-A1 P97 INHIBITORS FOR TREATING CANCER AND NEURODEGENERATIVE DISORDERS LOS ANGELES BIOMEDICAL RESEARCH INSTITUTE AT HARBOR-UCLA MEDICAL CENTER 2020-05-21 US disclosed
US-10464905-B2 Compounds useful as kinase inhibitors LOXO ONCOLOGY INC. (US) 2019-11-05 US disclosed
US-20190000806-A1 COMPOUNDS USEFUL AS KINASE INHIBITORS LOXO ONCOLOGY, INC. 2019-01-03 US 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 (7 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-11820757-B2 Antagonists of the muscarinic acetylcholine receptor M4 CHRM2, CHRM3, CHRM4 EIF4A3 4673/4885PDE2A 532/4885ACE2 725/4885
US-20200155536-A1 P97 INHIBITORS FOR TREATING CANCER AND NEURODEGENERATIVE DISORDERS PML, TARDBP, PRNP EIF4A3 1324/4885PDE2A 3769/4885ACE2 3208/4885
US-20220213069-A1 ANTAGONISTS OF THE MUSCARINIC ACETYLCHOLINE RECEPTOR M4 CHRM2, CHRM3, CHRM4 EIF4A3 4673/4885PDE2A 532/4885ACE2 725/4885
US-20200216410-A1 MODULATORS OF P97 AAA ATPASE ACTIVITY PSMG3, AHSA1, CDC37 EIF4A3 918/4885PDE2A 3740/4885ACE2 1129/4885
US-11214560-B2 Modulators of P97 AAA ATPase activity PSMG3, AHSA1, CDC37 EIF4A3 918/4885PDE2A 3740/4885ACE2 1129/4885
US-10464905-B2 Compounds useful as kinase inhibitors BTK, ABL1, LCK EIF4A3 1427/4885PDE2A 2053/4885ACE2 3159/4885
US-20190000806-A1 COMPOUNDS USEFUL AS KINASE INHIBITORS BTK, ABL1, LCK EIF4A3 1427/4885PDE2A 2053/4885ACE2 3159/4885

“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.