SCHEMBL18157952

SCHEMBL18157952

CSCCNC(Cc1ccccn1)c1ccccn1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FDPS P14324 1/20 0.40
HRH3 Q9Y5N1 1/20 0.40
ALDH1A1 P00352 2/20 0.39
LMNA P02545 2/20 0.39
TAAR1 Q96RJ0 1/20 0.39
ALOX15 P16050 1/20 0.39
CYP1A2 P05177 2/20 0.38
CYP2C19 P33261 1/20 0.38
GRIN2D O15399 1/20 0.38
GRIN3B O60391 1/20 0.38
GRIN1 Q05586 1/20 0.38
GRIN2A Q12879 1/20 0.38
GRIN2B Q13224 1/20 0.38
GRIN2C Q14957 1/20 0.38
GRIN3A Q8TCU5 1/20 0.38
SIRT2 Q8IXJ6 1/20 0.37
PTPRA P18433 1/20 0.37
SCN8A Q9UQD0 1/20 0.36
TSHR P16473 1/20 0.36
TDP1 Q9NUW8 2/20 0.35

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
SCHEMBL18158011 0.86 FDPS (0.41) FDPSHRH3ALDH1A1LMNATAAR1
SCHEMBL18158060 0.84 HPGD (0.41) FDPSHRH3ALDH1A1CYP1A2GRIN2D
SCHEMBL18157959 0.82 HRH3 (0.51) FDPSHRH3ALDH1A1LMNATAAR1
SCHEMBL58388 0.81 HRH1 (0.46) FDPSHRH3ALDH1A1LMNATAAR1
SCHEMBL18157958 0.81 FDPS (0.43) FDPSHRH3ALDH1A1LMNATAAR1
SCHEMBL18157956 0.81 CHRM2 (0.47) HRH3ALDH1A1LMNACYP2C19TSHR
SCHEMBL18158015 0.81 SCN8A (0.41) FDPSHRH3ALDH1A1LMNATAAR1
SCHEMBL19214714 0.80 FDPS (0.42) FDPSHRH3ALDH1A1LMNATAAR1
SCHEMBL18157961 0.78 TLR7 (0.40) FDPSHRH3ALDH1A1LMNATAAR1
SCHEMBL21989866 0.78 TSHR (0.40) HRH3ALDH1A1LMNACYP1A2CYP2C19

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-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
US-20160304730-A1 NEAR INFRARED RADIATION-ABSORBING COMPOSITION, NEAR INFRARED RADIATION CUT-OFF FILTER AND PRODUCTION METHOD THEREFOR, AND CAMERA MODULE AND PRODUCTION METHOD THEREFOR FUJIFILM CORPORATION (JP) 2016-10-20 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 FDPS 2964/4885HRH3 2322/4885ALDH1A1 2313/4885

“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.