SCHEMBL6203711

SCHEMBL6203711

CC1Sc2cc(N)ccc2NC1=O

nearest known ligand 0.50

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
HDAC1 Q13547 1/20 0.47
HDAC8 Q9BY41 1/20 0.47
HDAC6 Q9UBN7 1/20 0.47
TP53 P04637 1/20 0.44
LMNA P02545 2/20 0.42
HTT P42858 1/20 0.42
RAB9A P51151 5/20 0.39
NPC1 O15118 4/20 0.39
KMT2A Q03164 3/20 0.38
TDP1 Q9NUW8 1/20 0.38
ATM Q13315 1/20 0.37
ALDH1A1 P00352 1/20 0.37
GAA P10253 1/20 0.37
MAPT P10636 1/20 0.37
MEN1 O00255 1/20 0.37

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
SCHEMBL656961 0.87 POLB (0.61) POLBSMN1; SMN2HDAC1HDAC8HDAC6
SCHEMBL10649973 0.80 POLB (0.50) POLBSMN1; SMN2HDAC1HDAC8HDAC6
SCHEMBL6755136 0.78 SMN1; SMN2 (0.48) POLBSMN1; SMN2HDAC1HDAC8HDAC6
SCHEMBL6755138 0.78 SMN1; SMN2 (0.48) POLBSMN1; SMN2HDAC1HDAC8HDAC6
SCHEMBL6755137 0.78 SMN1; SMN2 (0.48) POLBSMN1; SMN2HDAC1HDAC8HDAC6
SCHEMBL23775752 0.78 SMN1; SMN2 (0.48) POLBSMN1; SMN2HDAC1HDAC8HDAC6
SCHEMBL24125191 0.75 CREBBP (0.57) POLBSMN1; SMN2HDAC1HDAC8HDAC6
SCHEMBL2745305 0.75 CREBBP (0.57) POLBSMN1; SMN2HDAC1HDAC8HDAC6
SCHEMBL3618121 0.73 POLB (0.47) POLBSMN1; SMN2HDAC1HDAC8HDAC6
SCHEMBL14250616 0.72 SMN1; SMN2 (0.43) POLBSMN1; SMN2HDAC1HDAC8HDAC6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20050107372-A1 2-(Quinolonyl)-fused heterocycles as androgen receptor modulators LANTER JAMES C (US) 2005-05-19 US disclosed
US-6858621-B2 2-(quinolonyl)-fused heterocycles as androgen receptor modulators ORTHO-MCNEIL PHARMACEUTICAL, INC. (US) 2005-02-22 US disclosed
EP-1501835-A2 2-(QUINOLONYL)-FUSED HETEROCYCLES AS ANDROGEN RECEPTOR MODULATORS Ortho-Mcneil Pharmaceutical, Inc. (US) 2005-02-02 EP disclosed
US-20040014743-A1 2-(Quinolonyl)-fused heterocycles as androgen receptor modulators ORTHO-MCNEIL PHARMACEUTICAL, INC. 2004-01-22 US disclosed
WO-2003090672-A2 2-(QUINOLONYL)-FUSED HETEROCYCLES AS ANDROGEN RECEPTOR MODULATORS ORTHO-MCNEIL PHARMACEUTICAL, INC. (US) 2003-11-06 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-20040014743-A1 2-(Quinolonyl)-fused heterocycles as androgen receptor modulators AR, NR5A1, ESRRA POLB 2475/4885SMN1; SMN2 4533/4885HDAC1 266/4885
US-20050107372-A1 2-(Quinolonyl)-fused heterocycles as androgen receptor modulators AR, NR5A1, CYP19A1 POLB 2417/4885SMN1; SMN2 4570/4885HDAC1 271/4885

“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.