SCHEMBL6480348

SCHEMBL6480348

CSc1ccc(CNc2ccc3oc4ccccc4c3c2)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 7/20 0.56
KMT2A Q03164 7/20 0.56
CYP1A2 P05177 4/20 0.56
CYP2C19 P33261 4/20 0.56
CYP2C9 P11712 3/20 0.56
CYP3A4 P08684 2/20 0.56
MAPT P10636 9/20 0.55
RAB9A P51151 7/20 0.55
NPC1 O15118 5/20 0.55
CYP2D6 P10635 2/20 0.55
RECQL P46063 1/20 0.50
ALDH1A1 P00352 6/20 0.49
KDM4E B2RXH2 5/20 0.49
HPGD P15428 5/20 0.49
SMN1; SMN2 Q16637 4/20 0.49
TP53 P04637 1/20 0.44
TSHR P16473 1/20 0.44
VKORC1 Q9BQB6 1/20 0.43
MAOB P27338 1/20 0.42
GLA P06280 1/20 0.42

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
SCHEMBL6765256 0.86 RAB9A (0.53) MEN1KMT2ACYP1A2CYP2C19CYP2C9
SCHEMBL6493319 0.85 HTT (0.53) MEN1KMT2ACYP1A2CYP2C19MAPT
SCHEMBL6482295 0.84 HPGD (0.54) MEN1KMT2ACYP1A2CYP2C19MAPT
SCHEMBL7246584 0.84 CYP1A2 (0.53) MEN1KMT2ACYP1A2CYP2C19MAPT
SCHEMBL6493823 0.82 EGFR (0.50) MEN1KMT2ACYP1A2CYP2C19CYP2C9
SCHEMBL7245463 0.82 MAOB (0.47) MEN1KMT2ACYP1A2CYP2C19CYP2C9
SCHEMBL6483334 0.82 CNR2 (0.56) MEN1KMT2ACYP1A2CYP2C19CYP2C9
SCHEMBL6484020 0.82 CA1 (0.45) MEN1KMT2ACYP1A2CYP2C19MAPT
SCHEMBL6481093 0.82 ELANE (0.47) MEN1KMT2ACYP1A2CYP2C19CYP3A4
SCHEMBL6491860 0.80 KDM4E (0.49) MEN1KMT2AMAPTRAB9ANPC1

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 6 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
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

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 MEN1 3995/4885KMT2A 412/4885CYP1A2 649/4885
US-20050075332-A1 Tricyclic compounds with antiviral activity HDAC8, CDK8, ZC3HAV1 MEN1 3464/4885KMT2A 770/4885CYP1A2 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.