SCHEMBL6019704

SCHEMBL6019704

CCN(C#N)C(=O)C(CC)(CC)Cc1csc2ccccc12

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.42
CYP2A6 P11509 2/20 0.41
CTSL P07711 1/20 0.39
CTSS P25774 1/20 0.39
CTSK P43235 1/20 0.39
SMN1; SMN2 Q16637 4/20 0.38
TP53 P04637 2/20 0.38
RXFP1 Q9HBX9 1/20 0.38
CYP2D6 P10635 1/20 0.38
TAAR1 Q96RJ0 1/20 0.36
DPP4 P27487 1/20 0.35
DPP8 Q6V1X1 1/20 0.35
DPP9 Q86TI2 1/20 0.35
ALOX5 P09917 1/20 0.35
POLB P06746 1/20 0.35
HDAC6 Q9UBN7 1/20 0.35
OPRM1 P35372 1/20 0.35
OPRK1 P41145 1/20 0.35
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34

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
SCHEMBL6021017 0.87 ALDH1A1 (0.43) ALDH1A1CYP2A6CTSLCTSSCTSK
SCHEMBL6019708 0.75 CTSL (0.44) CYP2A6CTSLCTSSCTSKSMN1; SMN2
SCHEMBL6020064 0.71 CTSS (0.52) ALDH1A1CYP2A6CTSLCTSSCTSK
SCHEMBL6019597 0.70 CTSL (0.56) ALDH1A1CYP2A6CTSLCTSSCTSK
SCHEMBL6020954 0.70 CTSS (0.50) ALDH1A1CYP2A6CTSLCTSSCTSK
SCHEMBL6021378 0.70 CTSS (0.70) CTSLCTSSCTSK
SCHEMBL6019753 0.69 CTSL (0.52) CTSLCTSSCTSKHDAC6
SCHEMBL6021165 0.69 CTSL (0.54) CTSLCTSSCTSKSMN1; SMN2TP53
SCHEMBL6020737 0.68 CTSL (0.51) ALDH1A1CYP2A6CTSLCTSSCTSK
SCHEMBL8486768 0.68 CYP2A6 (0.59) CYP2A6SMN1; SMN2TP53RXFP1TAAR1

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-20060252813-A1 Apparatus for curing a composite laminate JERINI AG (DE) 2006-11-09 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-20060252813-A1 Apparatus for curing a composite laminate DHX29, HDHD5, DHRS9 ALDH1A1 662/4885CYP2A6 1265/4885CTSL 2274/4885

“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.