SCHEMBL7546619

SCHEMBL7546619

CC(C)(C)c1ccccc1B(c1ccccc1)c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.41
ALDH1A1 P00352 1/20 0.41
TSHR P16473 1/20 0.41
CA2 P00918 1/20 0.38
RBP4 P02753 4/20 0.34
GABRA1 P14867 1/20 0.33
GABRB2 P47870 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
KIF11 P52732 1/20 0.32
ORAI1 Q96D31 2/20 0.32
ORAI2 Q96SN7 2/20 0.32
ORAI3 Q9BRQ5 2/20 0.32
TRPV6 Q9H1D0 2/20 0.32
CA4 P22748 1/20 0.32
CA6 P23280 1/20 0.32
CA5A P35218 1/20 0.32
CA7 P43166 1/20 0.32
ENPP2 Q13822 1/20 0.32
CA14 Q9ULX7 1/20 0.32
CA5B Q9Y2D0 1/20 0.32

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
SCHEMBL24775118 0.84 ALDH1A1 (0.36) TDP1ALDH1A1TSHRCA2RBP4
SCHEMBL22036471 0.75 TRPV6 (0.45) TDP1ALDH1A1TSHRCA2ORAI1
SCHEMBL30038787 0.75 ALDH1A1 (0.52) TDP1ALDH1A1TSHRCA2RBP4
SCHEMBL26450 0.75 ALDH1A1 (0.52) TDP1ALDH1A1TSHRCA2RBP4
SCHEMBL7631820 0.74 TRPV6 (0.39) TDP1ALDH1A1TSHRRBP4KIF11
SCHEMBL31010568 0.73 ALDH1A1 (0.44) TDP1ALDH1A1TSHRCA2RBP4
SCHEMBL187782 0.70 TSHR (0.43) TDP1ALDH1A1TSHRCA2ORAI1
SCHEMBL3426499 0.70 ALDH1A1 (0.46) TDP1ALDH1A1TSHRCA2RBP4
SCHEMBL1507181 0.70 TDP1 (0.46) TDP1ALDH1A1TSHRCA2RBP4
SCHEMBL29355273 0.69 ALDH1A1 (0.63) TDP1ALDH1A1TSHRCA2RBP4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220396596-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES UNIVERSAL DISPLAY CORPORATION (US) 2022-12-15 US disclosed
US-6399270-B1 SUBSTRATE HAVING COMPONENT LAYER THAT CONTAINS POROUS PARTICLES; SURFACE CAN BE MADE HYDROPHILIC AT LOW COST BY COATING; PLATE LIFE KONICA CORPORATION (JP) 2002-06-04 US disclosed
US-20020051931-A1 Substrate having component layer that contains porous particles; surface can be made hydrophilic at low cost by coating; plate life KONICA CORPORATION, A CORPORATION OF JAPAN (JP) 2002-05-02 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-20220396596-A1 ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES OCIAD2, OCIAD1, DRD3 TDP1 4453/4885ALDH1A1 1664/4885TSHR 2845/4885

“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.