SCHEMBL3885694

SCHEMBL3885694

Cc1noc(C)c1-c1ccc(N)cc1

nearest known ligand 0.66

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 12/20 0.66
BRD2 P25440 2/20 0.66
MLYCD O95822 1/20 0.54
JAK2 O60674 1/20 0.54
TDO2 P48775 1/20 0.52
BRD3 Q15059 1/20 0.51
ATAD2 Q6PL18 1/20 0.48
CREBBP Q92793 1/20 0.47
ERN1 O75460 1/20 0.47
ACHE P22303 1/20 0.47
NR3C1 P04150 1/20 0.47
PGR P06401 1/20 0.47

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
SCHEMBL8300240 0.83 BRD4 (0.70) BRD4BRD2MLYCDJAK2BRD3
SCHEMBL14196935 0.81 BRD4 (0.61) BRD4BRD2MLYCDBRD3CREBBP
SCHEMBL16404607 0.80 BRD4 (0.66) BRD4BRD2MLYCD
SCHEMBL14678367 0.80 BRD4 (0.66) BRD4BRD2MLYCDBRD3CREBBP
SCHEMBL1772573 0.80 BRD4 (0.66) BRD4BRD2MLYCDJAK2BRD3
SCHEMBL12362813 0.80 BRD4 (0.66) BRD4BRD2MLYCDCREBBPERN1
SCHEMBL25975868 0.79 BRD4 (0.59) BRD4BRD2MLYCDJAK2BRD3
SCHEMBL20093786 0.79 JAK2 (0.57) BRD4BRD2JAK2BRD3CREBBP
3,5-Dimethyl-4-Phenylisoxazole SCHEMBL12134072 0.79 BRD4 (1.00) BRD4BRD2MLYCDTDO2CREBBP
Hydrochloric Acid SCHEMBL23174957 0.78 BRD4 (0.63) BRD4BRD2MLYCDCREBBPERN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116568676-A IL-17A modulators 赛诺菲 2023-08-08 CN disclosed
CN-116547275-A IL-17A modulators 赛诺菲 2023-08-04 CN disclosed
EP-4157827-A1 IL-17A MODULATORS SANOFI (FR) 2023-04-05 EP disclosed
EP-4157828-A1 IL-17A MODULATORS SANOFI (FR) 2023-04-05 EP disclosed
WO-2020127685-A1 AMINO-ACID ANILIDES AS SMALL MOLECULE MODULATORS OF IL-17 LEO PHARMA A/S (DK) 2020-06-25 WO disclosed
WO-2020081682-A1 DEGRADERS OF WILD-TYPE AND MUTANT FORMS OF LRRK2 DANA-FARBER CANCER INSTITUTE, INC. (US) 2020-04-23 WO disclosed
WO-2017144393-A1 2-SUBSTITUTED 5-(PHENYL)-1,2-DIHYDRO-3H-3-BENZAZEPINE-3-CARBOXAMIDE DERIVATIVES AS BRD4 INHIBITORS FOR THE TREATMENT OF CANCER BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2017-08-31 WO disclosed
US-8486962-B2 N-(2-Methoxy-phenyl)-2-oxo-2-(2-phenyl-indolizin-3-yl)-acetamide; antifungal agents; inhibiting Aspergillus F2G LTD. (GB) 2013-07-16 US disclosed
EP-1888063-B1 ANTIFUNGAL AGENTS F2G LTD (GB) 2009-01-14 EP disclosed
US-20080161302-A1 N-(2-Methoxy-phenyl)-2-oxo-2-(2-phenyl-indolizin-3-yl)-acetamide; antifungal agents; inhibiting Aspergillus F2G LTD. (GB) 2008-07-03 US disclosed
EP-1888063-A1 ANTIFUNGAL AGENTS F2G Ltd. (GB) 2008-02-20 EP disclosed
WO-2006123145-A1 ANTIFUNGAL AGENTS F2G LTD (GB) 2006-11-23 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 (1 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-20080161302-A1 N-(2-Methoxy-phenyl)-2-oxo-2-(2-phenyl-indolizin-3-yl)-acetamide; antifungal agents; inhibiting Aspergillus NAT1, CYP1A2, CYP51A1 BRD4 2165/4885BRD2 1864/4885MLYCD 978/4885

“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.