SCHEMBL19214809

SCHEMBL19214809

CCC(Cc1ccccn1)NCc1cccc(CC(=O)O)n1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPRA P18433 1/20 0.44
SMN1; SMN2 Q16637 5/20 0.42
POLB P06746 4/20 0.42
CYP1A2 P05177 1/20 0.42
CYP2D6 P10635 1/20 0.42
MAPT P10636 1/20 0.42
TSHR P16473 1/20 0.42
ALDH1A1 P00352 2/20 0.39
FDPS P14324 1/20 0.38
NPC1 O15118 3/20 0.38
RAB9A P51151 3/20 0.38
NPSR1 Q6W5P4 1/20 0.38
KDM4E B2RXH2 1/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
GAA P10253 1/20 0.37
ALOX15 P16050 2/20 0.36
HPGD P15428 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
LMNA P02545 1/20 0.36

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
SCHEMBL19214785 0.85 TRPV3 (0.40) PTPRASMN1; SMN2POLBCYP1A2CYP2D6
SCHEMBL19214814 0.84 HRH3 (0.39) PTPRASMN1; SMN2POLBCYP1A2CYP2D6
SCHEMBL20661472 0.82 ITGB1 (0.37) SMN1; SMN2CYP1A2MAPTTSHRALDH1A1
SCHEMBL18158095 0.81 PTPRA (0.44) PTPRASMN1; SMN2POLBCYP1A2CYP2D6
SCHEMBL19214859 0.79 POLB (0.39) PTPRASMN1; SMN2POLBCYP1A2CYP2D6
SCHEMBL18160895 0.78 SMN1; SMN2 (0.53) SMN1; SMN2POLBALDH1A1NPC1RAB9A
SCHEMBL19214860 0.78 FABP1 (0.49) SMN1; SMN2CYP1A2CYP2D6MAPTTSHR
SCHEMBL20032069 0.77 TRPV3 (0.36) SMN1; SMN2CYP1A2CYP2D6MAPTTSHR
SCHEMBL19214791 0.75 PTPRA (0.47) PTPRASMN1; SMN2POLBCYP1A2CYP2D6
SCHEMBL20661470 0.73 HRH3 (0.33) SMN1; SMN2POLBCYP1A2CYP2D6MAPT

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 PTPRA 2197/4885SMN1; SMN2 2133/4885POLB 2608/4885

“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.