SCHEMBL4101126

SCHEMBL4101126

CCO[C@@H]1C[C@H](C(=O)O)N(C(=O)Nc2ccc(Cl)cc2)C1

nearest known ligand 0.61

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
F10 P00742 4/20 0.61
CCR1 P32246 7/20 0.43
POLB P06746 1/20 0.41
KMT2A Q03164 2/20 0.41
GAA P10253 1/20 0.41
ALOX5 P09917 1/20 0.40
NPC1 O15118 1/20 0.40
LMNA P02545 1/20 0.40
TP53 P04637 1/20 0.40
MAPT P10636 1/20 0.40
NFKB1 P19838 1/20 0.40
RAB9A P51151 1/20 0.40
NFKB2 Q00653 1/20 0.40
RELA Q04206 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
P2RX7 Q99572 1/20 0.39
THRB P10828 1/20 0.39
ALOX12 P18054 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
SCHEMBL20446553 0.87 F10 (0.55) F10CCR1POLBKMT2ANPC1
SCHEMBL2272576 0.87 F10 (0.55) F10CCR1POLBKMT2ANPC1
SCHEMBL3836231 0.87 F10 (0.55) F10CCR1POLBKMT2ANPC1
SCHEMBL3832169 0.82 F10 (0.62) F10CCR1POLBMAPT
SCHEMBL3830301 0.81 F10 (0.63) F10POLBNPC1LMNAMAPT
SCHEMBL76504 0.80 F10 (0.67) F10
SCHEMBL13890612 0.79 F10 (0.56) F10CCR1POLBKMT2AGAA
SCHEMBL20446539 0.79 F10 (0.56) F10CCR1POLBKMT2AGAA
SCHEMBL4186097 0.79 F10 (0.56) F10CCR1POLBKMT2AGAA
SCHEMBL20446631 0.79 F10 (0.56) F10CCR1POLBKMT2AGAA

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-20090221546-A1 INHIBITORS OF FACTOR XA AND OTHER SERINE PROTEASES INVOLVED IN THE COAGULATION CASCADE PFIZER INC 2009-09-03 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-20090221546-A1 INHIBITORS OF FACTOR XA AND OTHER SERINE PROTEASES INVOLVED IN THE COAGULATION CASCADE F11, F2, TFPI F10 10/4885CCR1 2343/4885POLB 2880/4885

“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.