SCHEMBL5585304

SCHEMBL5585304

CC(Oc1nc(N2CCNCC2)ccc1C(F)(F)F)c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRMT5 O14744 2/20 0.52
ADRB2 P07550 1/20 0.51
HTR6 P50406 4/20 0.47
CYP1A2 P05177 4/20 0.46
CYP2C9 P11712 1/20 0.46
HTR2C P28335 4/20 0.45
KDM4E B2RXH2 3/20 0.44
CYP3A4 P08684 2/20 0.44
SLC6A4 P31645 2/20 0.44
HSD17B10 Q99714 2/20 0.44
ALDH1A1 P00352 2/20 0.44
HTR3E A5X5Y0 1/20 0.44
USP2 O75604 1/20 0.44
HTR3B O95264 1/20 0.44
ADRB1 P08588 1/20 0.44
HTR1A P08908 1/20 0.44
MAPK1 P28482 1/20 0.44
HTR7 P34969 1/20 0.44
HTT P42858 1/20 0.44
HTR3A P46098 1/20 0.44

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
Acetic Acid SCHEMBL6184425 0.95 PRMT5 (0.48) PRMT5ADRB2HTR6CYP1A2CYP2C9
SCHEMBL5585294 0.79 ADRB2 (0.62) PRMT5ADRB2HTR6CYP1A2CYP2C9
SCHEMBL5585610 0.77 ADRB2 (0.53) PRMT5ADRB2HTR6CYP1A2CYP2C9
SCHEMBL5586025 0.76 ADRB2 (0.52) PRMT5ADRB2HTR6CYP1A2CYP2C9
SCHEMBL6185077 0.75 ADRB2 (0.51) PRMT5ADRB2HTR6CYP1A2CYP2C9
Hydrochloric Acid SCHEMBL6187280 0.75 ADRB2 (0.54) PRMT5ADRB2HTR6CYP1A2CYP2C9
SCHEMBL5585313 0.74 ADRB2 (0.55) PRMT5ADRB2HTR6CYP1A2CYP2C9
SCHEMBL5585592 0.73 PRMT5 (0.58) PRMT5ADRB2HTR6CYP1A2CYP2C9
SCHEMBL5585593 0.71 ADRB2 (0.55) PRMT5ADRB2HTR6CYP1A2CYP2C9
SCHEMBL3266588 0.71 HTR2C (0.76) PRMT5HTR6CYP1A2CYP2C9HTR2C

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-7229997-B2 Compounds and their use BIOVITRUM AB (SE) 2007-06-12 US claimed
EP-1506185-B1 COMPOUNDS AND THEIR USE AS INHIBITORS OF 5-HT BIOVITRUM AB (SE) 2006-05-24 EP claimed
JP-2005529926-A 2005-10-06 JP claimed
EP-1506185-A1 NOVEL COMPOUNDS AND THEIR USE Biovitrum AB (SE) 2005-02-16 EP claimed
US-20030232814-A1 Novel compounds and their use BIOVITRUM AB (PUBL) (SE) 2003-12-18 US claimed
WO-2003097636-A1 NOVEL COMPOUNDS AND THEIR USE BIOVITRUM AB (SE) 2003-11-27 WO claimed
US-7229997-B2 Compounds and their use BIOVITRUM AB (SE) 2007-06-12 US disclosed
EP-1506185-B1 COMPOUNDS AND THEIR USE AS INHIBITORS OF 5-HT BIOVITRUM AB (SE) 2006-05-24 EP disclosed
EP-1506185-A1 NOVEL COMPOUNDS AND THEIR USE Biovitrum AB (SE) 2005-02-16 EP disclosed
US-20030232814-A1 Novel compounds and their use BIOVITRUM AB (PUBL) (SE) 2003-12-18 US disclosed
WO-2003097636-A1 NOVEL COMPOUNDS AND THEIR USE BIOVITRUM AB (SE) 2003-11-27 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-20030232814-A1 Novel compounds and their use GPR119, FABP4, MC4R PRMT5 974/4885ADRB2 63/4885HTR6 269/4885

“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.