SCHEMBL6891819

SCHEMBL6891819

O=C(F)Cc1cccc2c1[CH]c1ccccc1-2

nearest known ligand 0.33

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 2/20 0.33
TDP1 Q9NUW8 1/20 0.32
AKR1B1 P15121 1/20 0.32
PPIA P62937 1/20 0.31
KMT2A Q03164 1/20 0.31
LMNA P02545 1/20 0.31
RAB9A P51151 1/20 0.31
PTGER1 P34995 1/20 0.30
PTGER4 P35408 1/20 0.30
PTGER3 P43115 1/20 0.30
PTGER2 P43116 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
SCHEMBL218358 0.77 GABRA1 (0.40) LMNARAB9A
SCHEMBL6647970 0.76 HSPA5 (0.34) KMT2ALMNA
SCHEMBL2974985 0.73 TRPA1 (0.30)
SCHEMBL9684213 0.71 MTNR1A (0.51) KMT2ALMNA
SCHEMBL219160 0.70 NR1H2 (0.34)
SCHEMBL2965774 0.70 TDP1 (0.34) TDP1
SCHEMBL217407 0.70 HTR2A (0.40) KMT2A
SCHEMBL4670729 0.69 GABRA1 (0.50) AKR1B1KMT2ALMNA
SCHEMBL3681441 0.69 RIPK1 (0.39)
SCHEMBL2960384 0.69

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040034089-A1 Tripeptidyl peptidase inhibitors JANSSEN PHARMACEUTICA N.V. (BE) 2004-02-19 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-20040034089-A1 Tripeptidyl peptidase inhibitors CCKAR, CCKBR, VIP FOLH1 1018/4885TDP1 3188/4885AKR1B1 1528/4885

“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.