SCHEMBL19214742

SCHEMBL19214742

CC[C@](C)(N)c1ccccc1O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 3/20 0.56
ALDH1A1 P00352 3/20 0.56
TDP1 Q9NUW8 2/20 0.56
CA2 P00918 2/20 0.37
ALOX15 P16050 3/20 0.36
LMNA P02545 2/20 0.36
HSD17B10 Q99714 2/20 0.36
KDM4E B2RXH2 1/20 0.36
NPC1 O15118 1/20 0.36
CA12 O43570 1/20 0.36
GMNN O75496 1/20 0.36
EGFR P00533 1/20 0.36
FYN P06241 1/20 0.36
POLB P06746 1/20 0.36
CA3 P07451 1/20 0.36
CYP3A4 P08684 1/20 0.36
MAPT P10636 1/20 0.36
MMP9 P14780 1/20 0.36
HPGD P15428 1/20 0.36
NFKB1 P19838 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
SCHEMBL7172700 1.00 TSHR (0.56) TSHRALDH1A1TDP1CA2ALOX15
SCHEMBL23732374 0.81 CDK2 (0.42) TSHRALDH1A1TDP1CA2ALOX15
SCHEMBL6672227 0.81 TSHR (0.52) TSHRALDH1A1TDP1CA2ALOX15
SCHEMBL1822446 0.81 TSHR (0.52) TSHRALDH1A1TDP1CA2ALOX15
SCHEMBL28331439 0.80 TSHR (0.52) TSHRALDH1A1TDP1CA2ALOX15
SCHEMBL8664622 0.79 TSHR (0.50) TSHRALDH1A1TDP1CA2ALOX15
SCHEMBL29381738 0.78 TSHR (0.60) TSHRALDH1A1TDP1CA2ALOX15
SCHEMBL3152876 0.78 TSHR (0.60) TSHRALDH1A1TDP1CA2ALOX15
SCHEMBL29350632 0.78 ALDH1A1 (0.60) TSHRALDH1A1TDP1CA2ALOX15
SCHEMBL28430326 0.78 ALDH1A1 (0.60) TSHRALDH1A1TDP1CA2ALOX15

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 TSHR 3457/4885ALDH1A1 2313/4885TDP1 3170/4885

“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.