SCHEMBL5598971

SCHEMBL5598971

CCCCCCCCCCCCc1ccccc1Cl

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LIPG Q9Y5X9 1/20 0.58
TAAR1 Q96RJ0 3/20 0.52
SLC6A2 P23975 1/20 0.48
SLC6A4 P31645 1/20 0.48
SLC6A3 Q01959 1/20 0.48
AOC3 Q16853 1/20 0.48
HTT P42858 1/20 0.47
NR1H2 P55055 1/20 0.47
NR1H3 Q13133 1/20 0.47
CHRM2 P08172 1/20 0.46
PNMT P11086 1/20 0.45
IDO1 P14902 1/20 0.45
BID P55957 3/20 0.45
MCL1 Q07820 3/20 0.45
BCL2L1 Q07817 2/20 0.45
BAK1 Q16611 2/20 0.45
KAT8 Q9H7Z6 2/20 0.45
PPARG P37231 1/20 0.45
PPARA Q07869 1/20 0.45
EP300 Q09472 1/20 0.45

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
SCHEMBL4829328 1.00 LIPG (0.58) LIPGTAAR1SLC6A2SLC6A4SLC6A3
SCHEMBL5271594 1.00 LIPG (0.58) LIPGTAAR1SLC6A2SLC6A4SLC6A3
SCHEMBL28250901 1.00 LIPG (0.58) LIPGTAAR1SLC6A2SLC6A4SLC6A3
SCHEMBL196431 1.00 LIPG (0.58) LIPGTAAR1SLC6A2SLC6A4SLC6A3
SCHEMBL5599139 1.00 LIPG (0.58) LIPGTAAR1SLC6A2SLC6A4SLC6A3
SCHEMBL3694247 1.00 LIPG (0.58) LIPGTAAR1SLC6A2SLC6A4SLC6A3
SCHEMBL19391066 1.00 LIPG (0.58) LIPGTAAR1SLC6A2SLC6A4SLC6A3
SCHEMBL11658176 1.00 LIPG (0.58) LIPGTAAR1SLC6A2SLC6A4SLC6A3
SCHEMBL31444780 1.00 LIPG (0.58) LIPGTAAR1SLC6A2SLC6A4SLC6A3
SCHEMBL31445158 0.98 LIPG (0.56) LIPGTAAR1SLC6A2SLC6A4SLC6A3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1312605-B1 Method for producing biaryl compounds SUMITOMO CHEMICAL CO (JP) 2007-04-25 EP disclosed
US-7122711-B2 Method for producing biaryl compound SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2006-10-17 US disclosed
US-20030158419-A1 Method for producing biaryl compound SUMITOMO CHEMICAL COMPANY, LIMITED 2003-08-21 US disclosed
EP-1312605-A1 Method for producing biaryl compounds SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2003-05-21 EP disclosed
US-4538003-A TREATMENT WITH MAGNESIUM OR ZINC ORGANOMETALLIC REAGENTS IN PRESENE OF A NICKEL BIDENTATE OR TRIDENTATE PHOSPHOROUS LIGAND E. I. DU PONT DE NEMOURS AND COMPANY (US) 1985-08-27 US disclosed
US-4235838-A IN OIL AND GAS WELLS PETROLITE CORPORATION (US) 1980-11-25 US disclosed
US-4162339-A Newsprint coupon separator HUNKINS JAMES (US) 1979-07-24 US disclosed
US-4073982-A DEMARCATION WECK FRIEDRICH J 1978-02-14 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-20030158419-A1 Method for producing biaryl compound B2M, BMI1, CYP2W1 LIPG 2599/4885TAAR1 1971/4885SLC6A2 3899/4885

“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.