SCHEMBL18158049

SCHEMBL18158049

CC(=O)NC(=O)CNC(Cc1ccccn1)c1ccccn1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPRA P18433 1/20 0.43
FDPS P14324 1/20 0.40
HDAC6 Q9UBN7 4/20 0.38
SMN1; SMN2 Q16637 3/20 0.38
HDAC1 Q13547 2/20 0.38
CYP1A2 P05177 3/20 0.38
TSHR P16473 3/20 0.38
CYP2D6 P10635 1/20 0.38
MAPT P10636 1/20 0.38
ALDH1A1 P00352 3/20 0.38
POLB P06746 2/20 0.36
ATM Q13315 1/20 0.36
KDM4E B2RXH2 1/20 0.35
ABCB11 O95342 1/20 0.35
LMNA P02545 1/20 0.35
ESR1 P03372 1/20 0.35
CYP3A4 P08684 1/20 0.35
ADRA2A P08913 1/20 0.35
CYP2C9 P11712 1/20 0.35
PDE4A P27815 1/20 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
SCHEMBL18158021 0.83 LMNA (0.41) PTPRAFDPSHDAC6SMN1; SMN2HDAC1
SCHEMBL18157982 0.83 PTPRA (0.51) PTPRAFDPSSMN1; SMN2CYP1A2TSHR
SCHEMBL18158066 0.82 PTPRA (0.47) PTPRAFDPSHDAC6SMN1; SMN2HDAC1
SCHEMBL18158064 0.81 SMN1; SMN2 (0.45) PTPRAHDAC6SMN1; SMN2HDAC1CYP1A2
SCHEMBL19214787 0.81 PTPRA (0.43) PTPRAFDPSHDAC6SMN1; SMN2HDAC1
SCHEMBL18158023 0.76 FDPS (0.40) PTPRAFDPSSMN1; SMN2MAPTALDH1A1
SCHEMBL18158002 0.76 GRIN2D (0.41) PTPRAFDPSSMN1; SMN2MAPTALDH1A1
SCHEMBL18160874 0.74 SMN1; SMN2 (0.53) SMN1; SMN2MAPTALDH1A1POLBATM
SCHEMBL18157958 0.74 FDPS (0.43) PTPRAFDPSSMN1; SMN2CYP1A2TSHR
SCHEMBL18157959 0.73 HRH3 (0.51) PTPRAFDPSSMN1; SMN2CYP1A2CYP2D6

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 PTPRA 2197/4885FDPS 2964/4885HDAC6 2374/4885

“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.