SCHEMBL19212957

SCHEMBL19212957

CC(C)N1CCN(Cc2ccccn2)CCN(C(C)C)CC1

nearest known ligand 0.58

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.56
CYP2C19 P33261 1/20 0.56
KMT2A Q03164 1/20 0.56
KDM4E B2RXH2 8/20 0.54
ALDH1A1 P00352 8/20 0.54
NPSR1 Q6W5P4 1/20 0.54
HRH1 P35367 1/20 0.53
L3MBTL1 Q9Y468 1/20 0.50
TRPV6 Q9H1D0 1/20 0.50
MAPT P10636 1/20 0.49
TSHR P16473 1/20 0.49
MAPK1 P28482 1/20 0.49
OPRD1 P41143 1/20 0.48
LMNA P02545 3/20 0.48
GFER P55789 1/20 0.48
SIGMAR1 Q99720 2/20 0.48
POLB P06746 1/20 0.47
HRH3 Q9Y5N1 1/20 0.47
GAA P10253 1/20 0.47

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
SCHEMBL13300916 1.00 CYP1A2 (0.56) CYP1A2CYP2C19KMT2AKDM4EALDH1A1
SCHEMBL13936659 1.00 CYP1A2 (0.56) CYP1A2CYP2C19KMT2AKDM4EALDH1A1
SCHEMBL13936665 0.94 CYP1A2 (0.51) CYP1A2CYP2C19KMT2AKDM4EALDH1A1
SCHEMBL9963428 0.94 CYP1A2 (0.51) CYP1A2CYP2C19KMT2AKDM4EALDH1A1
SCHEMBL13936662 0.90 KDM4E (0.59) CYP1A2CYP2C19KMT2AKDM4EALDH1A1
SCHEMBL18158006 0.88 CYP1A2 (0.48) CYP1A2CYP2C19KMT2AKDM4EALDH1A1
SCHEMBL21214470 0.88 CYP1A2 (0.54) CYP1A2CYP2C19KMT2AKDM4EALDH1A1
SCHEMBL30141847 0.86 CYP1A2 (0.71) CYP1A2CYP2C19KMT2AKDM4EALDH1A1
SCHEMBL29992091 0.86 CYP1A2 (0.71) CYP1A2CYP2C19KMT2AKDM4EALDH1A1
SCHEMBL20804356 0.86 CYP1A2 (0.71) CYP1A2CYP2C19KMT2AKDM4EALDH1A1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180094086-A1 NEAR INFRARED ABSORBING COMPOSITION, NEAR INFRARED CUT FILTER, METHOD OF MANUFACTURING NEAR INFRARED CUT FILTER, DEVICE, METHOD OF MANUFACTURING COPPER-CONTAINING POLYMER, AND COPPER-CONTAINING POLYMER FUJIFILM CORPORATION (JP) 2018-04-05 US disclosed
US-20180094086-A1 NEAR INFRARED ABSORBING COMPOSITION, NEAR INFRARED CUT FILTER, METHOD OF MANUFACTURING NEAR INFRARED CUT FILTER, DEVICE, METHOD OF MANUFACTURING COPPER-CONTAINING POLYMER, AND COPPER-CONTAINING POLYMER FUJIFILM CORPORATION (JP) 2018-04-05 US disclosed
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-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 CYP1A2 3189/4885CYP2C19 2257/4885KMT2A 2562/4885

“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.