SCHEMBL19212958

SCHEMBL19212958

NC(CN1CCOCC1)C(CCN1CCOCC1)CN1CCOCC1

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
USP2 O75604 1/20 0.44
ANPEP P15144 1/20 0.43
KEAP1 Q14145 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
ALDH1A1 P00352 3/20 0.38
KDM4E B2RXH2 3/20 0.38
SLC6A2 P23975 1/20 0.35
SLC6A4 P31645 1/20 0.35
SLC6A3 Q01959 1/20 0.35
GLA P06280 1/20 0.35
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33

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
SCHEMBL18158091 0.82 ANPEP (0.37) ANPEPMEN1KMT2A
SCHEMBL19212960 0.81 ANPEP (0.40) ANPEPALDH1A1MEN1KMT2A
SCHEMBL17819447 0.79 USP2 (0.48) USP2ANPEPKEAP1SMN1; SMN2ALDH1A1
SCHEMBL5076673 0.79 USP2 (0.48) USP2ANPEPKEAP1SMN1; SMN2ALDH1A1
SCHEMBL4796080 0.76 KEAP1 (0.52) USP2ANPEPKEAP1SMN1; SMN2ALDH1A1
SCHEMBL17921681 0.73 USP2 (0.42) USP2ANPEPKEAP1SMN1; SMN2ALDH1A1
SCHEMBL27586193 0.72 USP2 (0.50) USP2ANPEPKEAP1SMN1; SMN2ALDH1A1
SCHEMBL4332123 0.72 SMN1; SMN2 (0.48) USP2ANPEPKEAP1SMN1; SMN2ALDH1A1
SCHEMBL734049 0.71 USP2 (0.72) USP2ANPEPSMN1; SMN2ALDH1A1KDM4E
SCHEMBL4201455 0.71 USP2 (0.58) USP2ANPEPKEAP1SMN1; SMN2ALDH1A1

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-20170227690-A1 NEAR INFRARED RAY ABSORBENT COMPOSITION, NEAR INFRARED RAY CUT FILTER, SOLID IMAGE PICKUP ELEMENT, AND CAMERA MODULE FUJIFILM CORPORATION (JP) 2017-08-10 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-20170227690-A1 NEAR INFRARED RAY ABSORBENT COMPOSITION, NEAR INFRARED RAY CUT FILTER, SOLID IMAGE PICKUP ELEMENT, AND CAMERA MODULE C9, SET, CRY1 USP2 250/4885ANPEP 3478/4885KEAP1 1111/4885

“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.