SCHEMBL19214733

SCHEMBL19214733

Cc1cc(C)n(CC(C)(C)N)n1

nearest known ligand 0.57

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.52
KDM4E B2RXH2 3/20 0.52
GLA P06280 1/20 0.52
GLS O94925 1/20 0.50
LMNA P02545 5/20 0.47
PKM P14618 1/20 0.46
APAF1 O14727 1/20 0.42
POLB P06746 1/20 0.42
TDP1 Q9NUW8 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.39

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
SCHEMBL13616897 0.83 ALDH1A1 (0.55) ALDH1A1KDM4EGLAGLSLMNA
SCHEMBL18733004 0.83 ALDH1A1 (0.47) ALDH1A1KDM4EGLAGLSLMNA
SCHEMBL3506904 0.80 ALDH1A1 (0.52) ALDH1A1KDM4EGLAGLSLMNA
SCHEMBL10277640 0.78 ALDH1A1 (0.46) ALDH1A1KDM4EGLAGLSLMNA
SCHEMBL13299192 0.78 ALDH1A1 (0.53) ALDH1A1KDM4EGLAGLSLMNA
Hydrochloric Acid SCHEMBL33526538 0.77 LMNA (0.46) ALDH1A1KDM4ELMNAPOLB
SCHEMBL10277522 0.75 LMNA (0.44) ALDH1A1KDM4EGLAGLSLMNA
SCHEMBL20024571 0.74
SCHEMBL17489160 0.73 GLS (0.75) ALDH1A1KDM4EGLAGLSLMNA
SCHEMBL16447617 0.73 ALDH1A1 (0.64) ALDH1A1KDM4EGLAGLSLMNA

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 ALDH1A1 2313/4885KDM4E 2067/4885GLA 3483/4885

“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.