SCHEMBL3669352

SCHEMBL3669352

CNCc1ccc2c(c1)OC(F)(F)O2

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PDE2A O00408 1/20 0.41
ROCK2 O75116 1/20 0.41
FAAH O00519 3/20 0.40
NOS2 P35228 1/20 0.39
CTNNB1 P35222 2/20 0.39
WNT3A P56704 2/20 0.39
HTT P42858 1/20 0.38
NPSR1 Q6W5P4 1/20 0.38
KIF11 P52732 1/20 0.38
KIT P10721 6/20 0.38
BRAF P15056 6/20 0.38
CYP19A1 P11511 1/20 0.37
SLC6A4 P31645 1/20 0.36
LOXL2 Q9Y4K0 1/20 0.36
PTGDR Q13258 1/20 0.36
MAPK1 P28482 1/20 0.36
AKT1 P31749 1/20 0.36
KDR P35968 1/20 0.36
CYP2D6 P10635 1/20 0.36

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
SCHEMBL22905342 0.83 MAPT (0.46) FAAHCTNNB1WNT3AHTTNPSR1
SCHEMBL9838828 0.83 NOS2 (0.42) PDE2AROCK2FAAHNOS2CTNNB1
SCHEMBL8184134 0.82 CTNNB1 (0.42) PDE2AROCK2FAAHNOS2CTNNB1
SCHEMBL18656445 0.81 KDM4E (0.41) PDE2AROCK2FAAHNOS2CTNNB1
SCHEMBL2663369 0.79 CTNNB1 (0.41) FAAHCTNNB1WNT3AHTTNPSR1
SCHEMBL3750115 0.78 ADH1B (0.42) PDE2AROCK2FAAHNOS2CTNNB1
SCHEMBL2537768 0.77 CYP19A1 (0.43) ROCK2FAAHCTNNB1WNT3AHTT
SCHEMBL8367478 0.76 CNR1 (0.40) PDE2AFAAHCTNNB1WNT3AHTT
SCHEMBL18571251 0.76 KIF11 (0.43) ROCK2FAAHCTNNB1WNT3AHTT
SCHEMBL22517184 0.76 ALDH1A1 (0.37) HTTSLC6A4LOXL2MAPK1CYP2D6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250388585-A1 PRMT5 INHIBITORS AND USES THEREOF GILEAD SCIENCES INC (US) 2025-12-25 US disclosed
US-12448388-B2 PRMT5 inhibitors and uses thereof GILEAD SCIENCES, INC. (US) 2025-10-21 US disclosed
US-20240376110-A1 PRMT5 INHIBITORS AND USES THEREOF GILEAD SCIENCES, INC. 2024-11-14 US disclosed
WO-2024220917-A1 PRMT5 INHIBITORS AND USES THEREOF GILEAD SCIENCES, INC. (US) 2024-10-24 WO disclosed
WO-2023154291-A1 MODULATORS OF CYSTIC FIBROSIS TRANSMEMBRANE CONDUCTANCE REGULATOR VERTEX PHARMACEUTICALS INCORPORATED (US) 2023-08-17 WO disclosed
US-10919888-B2 Benzyl amine-containing heterocyclic compounds and compositions useful against mycobacterial infection UNIVERSITY OF NOTRE DAME DU LAC (US) 2021-02-16 US disclosed
EP-3016951-B1 TRICYCLIC PYRIDO-CARBOXAMIDE DERIVATIVES AS ROCK INHIBITORS BRISTOL MYERS SQUIBB CO (US) 2017-05-31 EP disclosed
EP-2155751-A1 PYRROLOPYRIMIDIN-7-ONE DERIVATIVES AND THEIR USE AS PHARMACEUTICALS AstraZeneca AB (SE) 2010-02-24 EP disclosed
US-20090099195-A1 Therapeutic Compounds 570 ASTRAZENECA AB (SE) 2009-04-16 US disclosed
US-20090099195-A1 Therapeutic Compounds 570 ASTRAZENECA AB (SE) 2009-04-16 US disclosed
US-20090099195-A1 Therapeutic Compounds 570 ASTRAZENECA AB (SE) 2009-04-16 US disclosed
WO-2008136756-A1 PYRROLOPYRIMIDIN-7-ONE DERIVATIVES AND THEIR USE AS PHARMACEUTICALS ASTRAZENECA AB (SE) 2008-11-13 WO disclosed
WO-2008136756-A1 PYRROLOPYRIMIDIN-7-ONE DERIVATIVES AND THEIR USE AS PHARMACEUTICALS ASTRAZENECA AB (SE) 2008-11-13 WO disclosed
US-20050043370-A1 HIV integrase inhibitors WALKER MICHAEL A (US) 2005-02-24 US disclosed
US-6803378-B2 FOR THERAPY AND PROPHYLAXIS OF ACQUIRED IMMUNE DEFICIENCY SYNDROME (AIDS), OR ARC BRISTOL-MYERS SQUIBB COMPANY 2004-10-12 US disclosed
US-20030181490-A1 HIV integrase inhibitors WALKER MICHAEL A (US) 2003-09-25 US disclosed
US-20030027847-A1 HIV integrase inhibitors BRISTOL-MYERS SQUIBB COMPANY 2003-02-06 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-20250388585-A1 PRMT5 INHIBITORS AND USES THEREOF PRMT1, PRMT5, PRMT6 PDE2A 1640/4885ROCK2 1161/4885FAAH 4587/4885
US-20090099195-A1 Therapeutic Compounds 570 OPRL1, OPRK1, OPRM1 PDE2A 334/4885ROCK2 2789/4885FAAH 3336/4885
US-20240376110-A1 PRMT5 INHIBITORS AND USES THEREOF PRMT5, PRMT1, PRMT9 PDE2A 856/4885ROCK2 771/4885FAAH 4697/4885
US-20050043370-A1 HIV integrase inhibitors AKR1C3, CBR3, CBR1 PDE2A 3273/4885ROCK2 507/4885FAAH 1635/4885
US-12448388-B2 PRMT5 inhibitors and uses thereof PRMT5, PRMT1, PRMT9 PDE2A 856/4885ROCK2 771/4885FAAH 4697/4885
US-10919888-B2 Benzyl amine-containing heterocyclic compounds and compositions useful against mycobacterial infection BET1, BRD4, BRD3 PDE2A 2367/4885ROCK2 3515/4885FAAH 1713/4885
US-20030181490-A1 HIV integrase inhibitors CBR1, CCR5, CCR1 PDE2A 3407/4885ROCK2 557/4885FAAH 1137/4885
US-20030027847-A1 HIV integrase inhibitors CBR1, CCR5, CCR1 PDE2A 3407/4885ROCK2 557/4885FAAH 1137/4885

“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.