SCHEMBL6848933

SCHEMBL6848933

CCOC(=O)CCn1c(C)c(Cl)nc(NN)c1=O

nearest known ligand 0.40

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TNF P01375 3/20 0.40
KAT2B Q92831 1/20 0.40
PLAU P00749 2/20 0.39
ALDH1A1 P00352 3/20 0.39
KDM4E B2RXH2 1/20 0.39
P2RX3 P56373 8/20 0.38
NPC1 O15118 1/20 0.37
LMNA P02545 1/20 0.37
POLB P06746 1/20 0.37
TSHR P16473 1/20 0.37
RAB9A P51151 1/20 0.37
MAPT P10636 1/20 0.36
GAA P10253 1/20 0.36

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
SCHEMBL7141645 0.87 HSD17B10 (0.43) ALDH1A1KDM4EPOLBTSHRMAPT
SCHEMBL6849033 0.84 TNF (0.45) TNFKAT2BALDH1A1KDM4EP2RX3
SCHEMBL7736669 0.76 TNF (0.46) TNFKAT2BALDH1A1LMNA
SCHEMBL7140320 0.72 F2 (0.47) PLAU
SCHEMBL7139994 0.70 HSD17B10 (0.48) ALDH1A1KDM4EPOLBTSHRMAPT
SCHEMBL21248447 0.69 PDE4D (0.37) ALDH1A1LMNAPOLB
SCHEMBL11210438 0.68 TNF (0.52) TNFKAT2BALDH1A1LMNAGAA
SCHEMBL7139116 0.65 KDM4E (0.45) ALDH1A1KDM4ETSHRRAB9A
SCHEMBL4290587 0.62 LMNA (0.47) TNFKAT2BALDH1A1KDM4ELMNA
SCHEMBL15081130 0.62 LMNA (0.47) TNFKAT2BALDH1A1KDM4EP2RX3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6777431-B2 ANTICOAGULANTS CORVAS INTERNATIONAL, INC. 2004-08-17 US disclosed
US-6777431-B2 ANTICOAGULANTS CORVAS INTERNATIONAL, INC. 2004-08-17 US disclosed
US-6777431-B2 ANTICOAGULANTS CORVAS INTERNATIONAL, INC. 2004-08-17 US disclosed
US-20030092679-A1 Novel non-convalent thrombin inhibitors DENDREON PHARMACEUTICALS LLC 2003-05-15 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-20030092679-A1 Novel non-convalent thrombin inhibitors F2, SERPINC1, F2RL3 TNF 4841/4885KAT2B 3749/4885PLAU 49/4885

“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.