SCHEMBL6715900

SCHEMBL6715900

NC(=O)Cc1ccc(-c2ccccn2)cc1C(F)(F)F

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
POLQ O75417 3/20 0.46
NTRK1 P04629 3/20 0.44
WNT3A P56704 3/20 0.43
TRPV1 Q8NER1 1/20 0.43
PDK2 Q15119 1/20 0.42
SCN9A Q15858 5/20 0.42
SCN5A Q14524 3/20 0.42
CTNNB1 P35222 1/20 0.40
CHEK2 O96017 1/20 0.40
CSF1R P07333 1/20 0.40
KIT P10721 1/20 0.40
P2RX7 Q99572 1/20 0.39

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
SCHEMBL6715894 0.79 POLQ (0.47) POLQ
SCHEMBL4028551 0.73 KMO (0.52) TRPV1PDK2SCN9ASCN5A
SCHEMBL30704714 0.73 KMO (0.52) TRPV1PDK2SCN9ASCN5A
SCHEMBL1177086 0.73 CA2 (0.48) WNT3A
SCHEMBL1395805 0.72 POLQ (0.55) POLQ
SCHEMBL4026680 0.72 NOTUM (0.54) PDK2
SCHEMBL4025957 0.72 KMO (0.51) TRPV1PDK2SCN9ASCN5A
SCHEMBL14562998 0.71 POLQ (0.56) POLQ
Hydrochloric Acid SCHEMBL8413702 0.71 POLQ (0.54) POLQ
SCHEMBL4023458 0.71 NOTUM (0.52) PDK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040152740-A1 Arylglycine derivatives for use as glycine transport inhibitors NPS ALLELIX CORPORATION (CA) 2004-08-05 US disclosed
WO-2004022534-A1 ARYLGLYCINE DERIVATIVES FOR USE AS GLYCINE TRANSPORT INHIBITORS NPS ALLELIX CORP. (CA) 2004-03-18 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-20040152740-A1 Arylglycine derivatives for use as glycine transport inhibitors SLC1A2, SLC6A7, SLC1A1 POLQ 4449/4885NTRK1 3235/4885WNT3A 2807/4885

“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.