SCHEMBL7637196

SCHEMBL7637196

CC(C)C1=C2CCCCCCCCC2CC1=O

nearest known ligand 0.38

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.38
CASP1 P29466 1/20 0.38
HSD17B10 Q99714 1/20 0.38
KMT2A Q03164 1/20 0.34
CA1 P00915 1/20 0.31
CA2 P00918 1/20 0.31
CA4 P22748 1/20 0.31
RXRA P19793 1/20 0.31
PTPRC P08575 1/20 0.30
PTPRF P10586 1/20 0.30
PTPN1 P18031 1/20 0.30
CDC25B P30305 1/20 0.30

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
SCHEMBL7638695 1.00 ALDH1A1 (0.38) ALDH1A1CASP1HSD17B10KMT2ACA1
SCHEMBL7635056 1.00 ALDH1A1 (0.38) ALDH1A1CASP1HSD17B10KMT2ACA1
SCHEMBL7635753 1.00 ALDH1A1 (0.38) ALDH1A1CASP1HSD17B10KMT2ACA1
SCHEMBL7636049 1.00 ALDH1A1 (0.38) ALDH1A1CASP1HSD17B10KMT2ACA1
SCHEMBL7643253 1.00 ALDH1A1 (0.38) ALDH1A1CASP1HSD17B10KMT2ACA1
SCHEMBL7940532 0.98 ALDH1A1 (0.39) ALDH1A1CASP1HSD17B10KMT2ACA1
SCHEMBL7636327 0.93 ALDH1A1 (0.33) ALDH1A1CASP1HSD17B10RXRA
SCHEMBL7635786 0.76 KMT2A (0.38) ALDH1A1CASP1HSD17B10KMT2ACA1
SCHEMBL7942188 0.76 KMT2A (0.38) ALDH1A1CASP1HSD17B10KMT2ACA1
SCHEMBL7636295 0.76 KMT2A (0.38) ALDH1A1CASP1HSD17B10KMT2ACA1

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-6482966-B2 REDUCING A CROSSLINK-CYCLIZED CYCLOPENTANONE WITH AN ALKALI METAL HYDRIDE, AND THEN REATING THE RESULTING CROSSLINK-CYCLIZED CYCLOPENTENOL IS WITH A DEHYDRATING AGENT HONSHU CHEMICAL INDUSTRY CO., LTD. (JP) 2002-11-19 US disclosed
US-20010012902-A1 Crosslink-cyclized cyclopentadiene and dihalobis type metal compound containing same as ligand HONSHU CHEMICAL INDUSTRY CO., LTD. (JP) 2001-08-09 US disclosed
EP-1122229-A1 Process for the preparation of condensed cyclopentadiene derivatives, 1, 3 disubstituted derivatives and metallocene type compounds containing them as ligand HONSHU CHEMICAL INDUSTRY CO. LTD. (JP) 2001-08-08 EP 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-20010012902-A1 Crosslink-cyclized cyclopentadiene and dihalobis type metal compound containing same as ligand CYC1, DCLRE1A, PPIL1 ALDH1A1 1309/4885CASP1 576/4885HSD17B10 40/4885

“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.