SCHEMBL10192199

SCHEMBL10192199

Cc1cc(N2CCOC2=O)ccc1F

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
IDH1 O75874 1/20 0.43
SCN9A Q15858 1/20 0.43
TSHR P16473 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
PIK3CA P42336 1/20 0.41
MTOR P42345 1/20 0.41
CMA1 P23946 7/20 0.41
CCNC P24863 2/20 0.40
CDK8 P49336 2/20 0.40
PARP1 P09874 1/20 0.40
PDE10A Q9Y233 1/20 0.39
EGLN2 Q96KS0 1/20 0.38
MMP12 P39900 2/20 0.37
MMP13 P45452 2/20 0.37
TNKS O95271 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
SCHEMBL30980971 0.91 KDM4E (0.40) IDH1SCN9ATSHRSMN1; SMN2PIK3CA
SCHEMBL8256507 0.88 SCN9A (0.43) IDH1SCN9ASMN1; SMN2PIK3CAMTOR
SCHEMBL8349969 0.85 BPTF (0.43) SCN9ATSHRPIK3CAMTORCMA1
SCHEMBL16703464 0.83 RAD52 (0.45) TSHRPIK3CAMTORCMA1CCNC
SCHEMBL850221 0.81 TSHR (0.50) TSHRSMN1; SMN2PIK3CAMTORCMA1
SCHEMBL18493886 0.81 IDH1 (0.48) IDH1PIK3CAMTORCMA1CCNC
SCHEMBL15499081 0.79 PKM (0.48) SCN9ASMN1; SMN2CMA1CCNCCDK8
SCHEMBL3448892 0.79 DGAT1 (0.41) PIK3CAMTORCMA1CCNCCDK8
SCHEMBL17151142 0.79 PIK3CA (0.47) PIK3CAMTORCMA1CCNCCDK8
SCHEMBL8303857 0.79 TP53 (0.39) SCN9ASMN1; SMN2PIK3CAMTORCMA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120009142-A1 METHODS FOR TREATING HEPATITIS C PTC THERAPEUTICS, INC. (US) 2012-01-12 US disclosed
US-7973069-B2 Methods for treating hepatitis C PTC THERAPEUTICS, INC. (US) 2011-07-05 US disclosed
US-20100305100-A1 METHODS FOR TREATING HEPATITIS C PTC THERAPEUTICS, INC. (US) 2010-12-02 US disclosed
US-20100292187-A1 METHODS FOR TREATING HEPATITIS C PTC THERAPEUTICS, INC. (US) 2010-11-18 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 (3 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-20120009142-A1 METHODS FOR TREATING HEPATITIS C OAT, HAVCR2, HCCS IDH1 2010/4885SCN9A 4858/4885TSHR 4324/4885
US-20100292187-A1 METHODS FOR TREATING HEPATITIS C HAVCR2, EIF2AK2, MAVS IDH1 1103/4885SCN9A 4126/4885TSHR 4161/4885
US-20100305100-A1 METHODS FOR TREATING HEPATITIS C HAVCR2, EIF2AK2, MAVS IDH1 1103/4885SCN9A 4126/4885TSHR 4161/4885

“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.