SCHEMBL6498436

SCHEMBL6498436

Clc1ccc2oc3ccc(NCc4ccccc4Br)cc3c2c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
UTS2R Q9UKP6 1/20 0.45
AHR P35869 3/20 0.42
CYP1A2 P05177 2/20 0.42
CYP2C9 P11712 2/20 0.42
CYP2C19 P33261 2/20 0.42
PLA2G1B P04054 1/20 0.42
CYP3A4 P08684 1/20 0.42
CYP2D6 P10635 1/20 0.42
ATG4B Q9Y4P1 1/20 0.42
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
MAOB P27338 3/20 0.41
P2RY14 Q15391 1/20 0.41
CA1 P00915 2/20 0.40
CA2 P00918 2/20 0.40
MAPT P10636 3/20 0.39
L3MBTL1 Q9Y468 2/20 0.39
ATM Q13315 1/20 0.39
EGFR P00533 2/20 0.39
IDH1 O75874 2/20 0.38

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
SCHEMBL6485698 0.88 SMN1; SMN2 (0.44) UTS2RAHRCYP1A2CYP2C19CYP2D6
SCHEMBL6498257 0.84 PPARG (0.51) AHRCYP1A2CYP2C9CYP2C19PLA2G1B
SCHEMBL6495210 0.84 MEN1 (0.62) AHRCYP1A2CYP2C9CYP2C19PLA2G1B
SCHEMBL6482478 0.84 MAPT (0.40) UTS2RCYP1A2CYP2C9CYP2C19PLA2G1B
SCHEMBL6768296 0.83 MAOB (0.45) AHRCYP1A2CYP2C9CYP2C19PLA2G1B
SCHEMBL6483858 0.81 IDH1 (0.40) AHRCYP1A2CYP2C9CYP2C19PLA2G1B
SCHEMBL6495487 0.81 MAOB (0.49) AHRMEN1KMT2AMAOBMAPT
SCHEMBL6770100 0.80 KMT2A (0.49) AHRCYP1A2CYP2C9CYP2C19PLA2G1B
SCHEMBL6484730 0.79 MAPT (0.53) CYP2C9CYP2C19PLA2G1BCYP3A4ATG4B
SCHEMBL6483043 0.79 CYP2C9 (0.48) AHRCYP1A2CYP2C9CYP2C19PLA2G1B

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-20050075332-A1 Tricyclic compounds with antiviral activity WARNER LAMBERT COMPANY 2005-04-07 US claimed
US-6800656-B2 Tricyclic compounds and method of treating herpes virus WARNER LAMBERT COMPANY 2004-10-05 US claimed
US-20030229073-A1 Tricyclic compounds and method of treating herpes virus BOOTH RICHARD JOHN (US) 2003-12-11 US claimed
EP-1248777-A2 TRICYCLIC COMPOUNDS WITH ANTIVIRAL ACTIVITY WARNER-LAMBERT COMPANY (US) 2002-10-16 EP claimed
WO-2001051479-A2 TRICYCLIC COMPOUNDS WITH ANTIVIRAL ACTIVITY WARNER-LAMBERT COMPANY (US) 2001-07-19 WO claimed
US-20050075332-A1 Tricyclic compounds with antiviral activity WARNER LAMBERT COMPANY 2005-04-07 US disclosed
US-6800656-B2 Tricyclic compounds and method of treating herpes virus WARNER LAMBERT COMPANY 2004-10-05 US disclosed
US-20030229073-A1 Tricyclic compounds and method of treating herpes virus BOOTH RICHARD JOHN (US) 2003-12-11 US disclosed
EP-1248777-A2 TRICYCLIC COMPOUNDS WITH ANTIVIRAL ACTIVITY WARNER-LAMBERT COMPANY (US) 2002-10-16 EP disclosed
WO-2001051479-A2 TRICYCLIC COMPOUNDS WITH ANTIVIRAL ACTIVITY WARNER-LAMBERT COMPANY (US) 2001-07-19 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 (2 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-20030229073-A1 Tricyclic compounds and method of treating herpes virus HDAC8, ZC3HAV1, ZCCHC8 UTS2R 1199/4885AHR 2670/4885CYP1A2 649/4885
US-20050075332-A1 Tricyclic compounds with antiviral activity HDAC8, CDK8, ZC3HAV1 UTS2R 1933/4885AHR 1774/4885CYP1A2 2938/4885

“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.