SCHEMBL4258324

SCHEMBL4258324

CCCCCCCC(C)(C)Br

nearest known ligand 0.47

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.47
THRB P10828 1/20 0.47
GGPS1 O95749 6/20 0.41
FDPS P14324 9/20 0.39
SMPD1 P17405 2/20 0.38
CES2 O00748 1/20 0.38
LPAR1 Q92633 1/20 0.38
LPAR3 Q9UBY5 1/20 0.38

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
SCHEMBL11055270 1.00 TSHR (0.47) TSHRTHRBGGPS1FDPSSMPD1
SCHEMBL11747360 1.00 TSHR (0.47) TSHRTHRBGGPS1FDPSSMPD1
SCHEMBL10454726 1.00 TSHR (0.47) TSHRTHRBGGPS1FDPSSMPD1
SCHEMBL10598540 1.00 TSHR (0.47) TSHRTHRBGGPS1FDPSSMPD1
SCHEMBL10454560 1.00 TSHR (0.47) TSHRTHRBGGPS1FDPSSMPD1
SCHEMBL28107814 1.00 TSHR (0.47) TSHRTHRBGGPS1FDPSSMPD1
SCHEMBL30984632 1.00 TSHR (0.47) TSHRTHRBGGPS1FDPSSMPD1
Ammonia Solution, Strong SCHEMBL8504994 0.97 TSHR (0.44) TSHRTHRBGGPS1FDPSSMPD1
Hydrogen Sulfide SCHEMBL11221954 0.97 TSHR (0.44) TSHRTHRBGGPS1FDPS
SCHEMBL11795752 0.97 TSHR (0.44) TSHRTHRBGGPS1FDPSSMPD1

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-20090242876-A1 CARBAZOLE COMPOUNDS KONINKLIJKE PHILIPS ELECTRONICS, N.V. (NL) 2009-10-01 US disclosed
US-3956411-A DICHLOROALKYLENE PHILLIPS PETROLEUM COMPANY (US) 1976-05-11 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-20090242876-A1 CARBAZOLE COMPOUNDS CCNI, IL33, PAICS TSHR 4594/4885THRB 4812/4885GGPS1 397/4885

“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.