SCHEMBL4167952

SCHEMBL4167952

Cc1noc(C)c1CN1C(=O)C2(NC(=O)NC2=O)c2cc(F)ccc21

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.50
SMN1; SMN2 Q16637 2/20 0.50
HTT P42858 1/20 0.50
HSD17B10 Q99714 1/20 0.45
ALDH1A1 P00352 2/20 0.44
PTGDR2 Q9Y5Y4 2/20 0.42
AKR1B1 P15121 4/20 0.42
AKR1A1 P14550 3/20 0.42
ADAM17 P78536 1/20 0.40
TAS2R8 Q9NYW2 4/20 0.39
P2RX7 Q99572 2/20 0.37
ALOX15 P16050 1/20 0.37
MAPK1 P28482 1/20 0.37
NPSR1 Q6W5P4 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
SCHEMBL4176331 0.90 TSHR (0.57) TSHRSMN1; SMN2HTTHSD17B10ALDH1A1
SCHEMBL4167051 0.88 PTGDR2 (0.54) TSHRSMN1; SMN2HTTHSD17B10ALDH1A1
SCHEMBL4169745 0.85 TSHR (0.54) TSHRSMN1; SMN2HTTHSD17B10ALDH1A1
SCHEMBL4159637 0.83 AKR1B1 (0.43) AKR1B1AKR1A1
SCHEMBL4262824 0.82 AKR1B1 (0.46) AKR1B1AKR1A1
SCHEMBL4164579 0.78 TSHR (0.47) TSHRSMN1; SMN2HTTHSD17B10ALDH1A1
SCHEMBL4260419 0.76 PARK7 (0.51) ALDH1A1PTGDR2AKR1B1AKR1A1
SCHEMBL4161594 0.76 AKR1B1 (0.42) PTGDR2AKR1B1AKR1A1
SCHEMBL4259926 0.76 AKR1B1 (0.47) PTGDR2AKR1B1AKR1A1
SCHEMBL4254358 0.75 AKR1B1 (0.50) AKR1B1AKR1A1

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-20090076049-A1 Novel Spiro [Imidazolidine-4, 3' -Indole] 2, 2', 5' (1H) Triones for Treatment of Conditions Associated with Vanilloid Receptor 1 ASTRAZENECA AB (SE) 2009-03-19 US claimed
US-20090076049-A1 Novel Spiro [Imidazolidine-4, 3' -Indole] 2, 2', 5' (1H) Triones for Treatment of Conditions Associated with Vanilloid Receptor 1 ASTRAZENECA AB (SE) 2009-03-19 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-20090076049-A1 Novel Spiro [Imidazolidine-4, 3' -Indole] 2, 2', 5' (1H) Triones for Treatment of Conditions Associated with Vanilloid Receptor 1 TRPV1, TRPV5, TRPV2 TSHR 401/4885SMN1; SMN2 2877/4885HTT 2355/4885

“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.