SCHEMBL5518147

SCHEMBL5518147

Cn1ccc2cc(Nc3c[c]ccc3)ccc21

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRM4 Q14833 1/20 0.44
HTR2B P41595 3/20 0.44
MEN1 O00255 2/20 0.44
TP53 P04637 2/20 0.44
CYP1A2 P05177 2/20 0.44
CYP3A4 P08684 2/20 0.44
CYP2D6 P10635 2/20 0.44
MAPT P10636 2/20 0.44
CYP2C19 P33261 2/20 0.44
RECQL P46063 2/20 0.44
KMT2A Q03164 2/20 0.44
KDM4E B2RXH2 1/20 0.44
TDP1 Q9NUW8 1/20 0.44
HTR2C P28335 4/20 0.43
EGFR P00533 2/20 0.43
NOTUM Q6P988 1/20 0.42
PRKCQ Q04759 1/20 0.42
PRKCD Q05655 1/20 0.42
PRKCI P41743 1/20 0.41
PKM P14618 2/20 0.40

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
SCHEMBL2185253 0.75 HSD11B1 (0.51) PRKCIFAAHCYP2A6MAOB
SCHEMBL15152207 0.74 MAOB (0.63) GRM4HTR2BMEN1TP53CYP1A2
SCHEMBL8789947 0.73 KMT2A (0.51) GRM4HTR2BMEN1TP53CYP1A2
SCHEMBL7090460 0.72 HSD17B10 (0.43) HTR2BMEN1CYP1A2CYP3A4MAPT
SCHEMBL31035921 0.71 PRKCI (0.55) GRM4HTR2BMEN1TP53CYP1A2
SCHEMBL9400551 0.71 PRKCI (0.55) GRM4HTR2BMEN1TP53CYP1A2
SCHEMBL24865228 0.71 SMN1; SMN2 (0.51) GRM4HTR2BMEN1TP53CYP1A2
SCHEMBL30336558 0.71 SMN1; SMN2 (0.51) GRM4HTR2BMEN1TP53CYP1A2
SCHEMBL13871906 0.70 PRKCI (0.53) GRM4HTR2BMEN1TP53CYP1A2
SCHEMBL13537234 0.70 PRKCI (0.53) GRM4HTR2BMEN1TP53CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070082880-A1 Thieno [2,3-B] pyridine-5-carbonitriles as protein kinase inhibitors WYETH 2007-04-12 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 (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-20070082880-A1 Thieno [2,3-B] pyridine-5-carbonitriles as protein kinase inhibitors MAP4K2, CNKSR1, MAP3K1 GRM4 3017/4885HTR2B 1851/4885MEN1 2021/4885

“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.