SCHEMBL6740320

SCHEMBL6740320

CCCCCCOc1cc(C)c(Br)cc1C

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
THRA P10827 6/20 0.45
THRB P10828 6/20 0.45
ESR1 P03372 2/20 0.44
S1PR3 Q99500 3/20 0.40
S1PR2 O95136 2/20 0.40
S1PR1 P21453 2/20 0.40
LPAR2 Q9HBW0 2/20 0.40
GALR3 O60755 1/20 0.40
POLB P06746 1/20 0.40
MAPT P10636 1/20 0.40
SMPD1 P17405 2/20 0.39
ALDH1A1 P00352 1/20 0.39
HPGD P15428 1/20 0.39
TSHR P16473 1/20 0.39
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
SCHEMBL5843168 0.91 THRA (0.43) THRATHRBESR1S1PR3S1PR2
SCHEMBL10153760 0.89 THRA (0.45) THRATHRBESR1S1PR3S1PR2
SCHEMBL12937299 0.89 THRA (0.45) THRATHRBESR1S1PR3S1PR2
SCHEMBL13475571 0.89 ESR1 (0.51) THRATHRBESR1S1PR3S1PR2
SCHEMBL14570401 0.89 ESR1 (0.51) THRATHRBESR1S1PR3S1PR2
SCHEMBL13475563 0.89 ESR1 (0.51) THRATHRBESR1S1PR3S1PR2
SCHEMBL862816 0.89 ESR1 (0.51) THRATHRBESR1S1PR3S1PR2
SCHEMBL15200209 0.89 ESR1 (0.51) THRATHRBESR1S1PR3S1PR2
SCHEMBL862599 0.89 ESR1 (0.51) THRATHRBESR1S1PR3S1PR2
SCHEMBL10039089 0.89 ESR1 (0.51) THRATHRBESR1S1PR3S1PR2

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-6689530-B2 ULTRAVIOLET LITHOGRAPHY MICROFABRICATION WITH IMPROVED RESOLUTION AND PATTERN PROFILE AFTER DEVELOPMENT SHIN-ETSU CHEMICAL CO., LTD. (JP) 2004-02-10 US disclosed
US-20030180653-A1 Novel sulfonyldiazomethanes, photoacid generations, resist compositions, and patterning process SHIN-ETSU CHEMICAL CO., LTD. (JP) 2003-09-25 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-20030180653-A1 Novel sulfonyldiazomethanes, photoacid generations, resist compositions, and patterning process CACNA1A, KCNA1, POLL THRA 4108/4885THRB 4655/4885ESR1 2410/4885

“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.