SCHEMBL23717029

SCHEMBL23717029

CC(C)c1cc(C(F)(F)F)c2ncccc2c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PSMD14 O00487 2/20 0.41
COPS5 Q92905 2/20 0.41
PDE4B Q07343 3/20 0.41
PDE4A P27815 2/20 0.41
PDE4C Q08493 2/20 0.41
PDE4D Q08499 2/20 0.41
TDP1 Q9NUW8 2/20 0.40
CCR1 P32246 4/20 0.39
CCR8 P51685 4/20 0.39
CCR5 P51681 2/20 0.38
MDM2 Q00987 1/20 0.38
HSD11B1 P28845 1/20 0.38
TP53 P04637 2/20 0.37
MAPT P10636 2/20 0.37
KDM4E B2RXH2 1/20 0.37
GMNN O75496 1/20 0.37
LMNA P02545 1/20 0.37
HSP90AA1 P07900 1/20 0.37
MMP2 P08253 1/20 0.37
CYP3A4 P08684 1/20 0.37

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
SCHEMBL22768238 0.86 PDE4B (0.44) PSMD14COPS5PDE4BPDE4APDE4C
SCHEMBL24781560 0.81 MDM2 (0.36) PSMD14COPS5PDE4BPDE4APDE4C
SCHEMBL23717257 0.79 PSMD14 (0.42) PSMD14COPS5HSD11B1KDM4EAKR1C3
SCHEMBL12026641 0.79 MET (0.49) PSMD14COPS5PDE4BPDE4APDE4C
SCHEMBL13301166 0.79 PSMD14 (0.62) PSMD14COPS5TDP1CCR1CCR8
SCHEMBL22270813 0.78 SLC40A1 (0.48) PSMD14COPS5TDP1CCR1CCR8
SCHEMBL7443517 0.77 TOP1 (0.56) PDE4BPDE4APDE4CPDE4DSLC40A1
SCHEMBL12789731 0.77 TDP1 (0.53) PSMD14COPS5PDE4BPDE4APDE4C
SCHEMBL12847065 0.77 CCR1 (0.51) PSMD14COPS5PDE4BPDE4APDE4C
Hydrochloric Acid SCHEMBL7438730 0.76 TOP1 (0.55) PDE4BPDE4APDE4CPDE4DSLC40A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11820766-B2 Monoacylglycerol lipase modulators JANSSEN PHARMACEUTICA NV (BE) 2023-11-21 US disclosed
US-11820766-B2 Monoacylglycerol lipase modulators JANSSEN PHARMACEUTICA NV (BE) 2023-11-21 US disclosed
US-20230145249-A1 Monoacylglycerol Lipase Modulators JANSSEN PHARMACEUTICA NV (BE) 2023-05-11 US disclosed
US-20230125803-A1 ANTIVIRAL HETEROCYCLIC COMPOUNDS ENANTA PHARM INC (US) 2023-04-27 US disclosed
US-20230125803-A1 ANTIVIRAL HETEROCYCLIC COMPOUNDS ENANTA PHARM INC (US) 2023-04-27 US disclosed
US-11572367-B2 Antiviral heterocyclic compounds ENANTA PHARMACEUTICALS, INC. (US) 2023-02-07 US disclosed
US-20220332713-A1 Monoacylglycerol Lipase Modulators JANSSEN PHARMACEUTICA NV (BE) 2022-10-20 US disclosed
US-11420976-B2 Heterocyclic compounds as anti-viral agents ENANTA PHARMACEUTICALS, INC. (US) 2022-08-23 US disclosed
US-20220119398-A1 HETEROCYCLIC COMPOUNDS AS ANTI-VIRAL AGENTS ENANTA PHARMACEUTICALS, INC. 2022-04-21 US disclosed
US-20210238188-A1 HETEROCYCLIC COMPOUNDS AS ANTI-VIRAL AGENTS ENANTA PHARMACEUTICALS, INC. 2021-08-05 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 (8 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-20220332713-A1 Monoacylglycerol Lipase Modulators MGLL, LPL, PNLIP PSMD14 3224/4885COPS5 3909/4885PDE4B 714/4885
US-20210238188-A1 HETEROCYCLIC COMPOUNDS AS ANTI-VIRAL AGENTS VIP, ACE, FURIN PSMD14 4528/4885COPS5 1481/4885PDE4B 689/4885
US-20230145249-A1 Monoacylglycerol Lipase Modulators MGLL, LPL, PNLIP PSMD14 3224/4885COPS5 3909/4885PDE4B 714/4885
US-20220119398-A1 HETEROCYCLIC COMPOUNDS AS ANTI-VIRAL AGENTS VIP, ACE, FURIN PSMD14 4528/4885COPS5 1481/4885PDE4B 689/4885
US-11420976-B2 Heterocyclic compounds as anti-viral agents VIP, ACE, FURIN PSMD14 4528/4885COPS5 1481/4885PDE4B 689/4885
US-11572367-B2 Antiviral heterocyclic compounds ACE, HPRT1, ACE2 PSMD14 4386/4885COPS5 1327/4885PDE4B 778/4885
US-11820766-B2 Monoacylglycerol lipase modulators MGLL, LPL, PNLIP PSMD14 3224/4885COPS5 3909/4885PDE4B 714/4885
US-20230125803-A1 ANTIVIRAL HETEROCYCLIC COMPOUNDS ACE, HPRT1, ACE2 PSMD14 4386/4885COPS5 1327/4885PDE4B 778/4885

“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.