SCHEMBL4919949

SCHEMBL4919949

COC(=O)c1ccc2c(c1)C(=O)c1c(C)cccc1-2

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FGFR1 P11362 1/20 0.51
FGFR2 P21802 1/20 0.51
FGFR4 P22455 1/20 0.51
FGFR3 P22607 1/20 0.51
PTPRC P08575 3/20 0.47
POLB P06746 1/20 0.46
CASP3 P42574 1/20 0.46
TTR P02766 3/20 0.44
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
CA4 P22748 1/20 0.44
CA9 Q16790 1/20 0.44
ALDH1A1 P00352 1/20 0.44
ATM Q13315 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
PTGS2 P35354 1/20 0.44
PTPRF P10586 1/20 0.44
PTPN1 P18031 1/20 0.44
CDC25B P30305 1/20 0.44

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
SCHEMBL4915959 0.86 MAPT (0.58) POLBTTRCA1CA2CA9
SCHEMBL26114615 0.86 MAPT (0.49) FGFR1FGFR2FGFR4FGFR3PTPRC
SCHEMBL27663693 0.84 PTPRC (0.63) PTPRCPOLBTTRALDH1A1CDC25B
SCHEMBL4920271 0.82 PTGS2 (0.44) PTPRCPOLBCASP3TTRALDH1A1
SCHEMBL4921071 0.82 TTR (0.61) PTPRCCASP3TTRALDH1A1ATM
SCHEMBL4918870 0.81 MAPT (0.45) PTPRCCASP3TTRALDH1A1ATM
SCHEMBL4922840 0.81 PTPRC (0.43) PTPRCPOLBCASP3TTRALDH1A1
SCHEMBL11846453 0.81 PTPRC (0.60) PTPRCCASP3TTRCA1CA2
SCHEMBL3554734 0.80 LOXL2 (0.49) FGFR1FGFR2FGFR4FGFR3PTPRC
SCHEMBL2265496 0.80 TTR (0.62) PTPRCPOLBCASP3TTRALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080200551-A1 Flourene Derivative ASTELLAS PHARMA INC. (JP) 2008-08-21 US disclosed
US-20080171788-A1 Medicament For Irritable Bowel Syndrome ASTELLAS PHARMA INC. (JP) 2008-07-17 US disclosed
US-20080161419-A1 Prophylactic Antimigraine Agents ASTELLAS PHARMA INC. (JP) 2008-07-03 US disclosed
EP-1852129-A1 REMEDY FOR IRRITABLE BOWEL SYNDROME Astellas Pharma Inc. (JP) 2007-11-07 EP disclosed
EP-1728784-A1 FLUORENE DERIVATIVE Astellas Pharma Inc. (JP) 2006-12-06 EP disclosed
EP-1716867-A1 PREVENTIVES FOR MIGRAINE Astellas Pharma Inc. (JP) 2006-11-02 EP disclosed
CN-1842517-A Fluorene derivatives ASTELLAS PHARMA INC (JP) 2006-10-04 CN 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 (3 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-20080161419-A1 Prophylactic Antimigraine Agents HTR2B, HTR7, HTR1A FGFR1 4173/4885FGFR2 4022/4885FGFR4 4445/4885
US-20080200551-A1 Flourene Derivative HTR2B, HTR7, HTR2C FGFR1 1217/4885FGFR2 1326/4885FGFR4 1163/4885
US-20080171788-A1 Medicament For Irritable Bowel Syndrome HTR7, HTR5A, HTR3B FGFR1 3542/4885FGFR2 3589/4885FGFR4 3055/4885

“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.