SCHEMBL6808798

SCHEMBL6808798

N=C(N)c1cccc(NC(=O)C(Nc2ccc(N3CCCC3=O)cc2)c2ccccc2)c1

nearest known ligand 0.90

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F10 P00742 5/20 0.90
KMT2A Q03164 5/20 0.49
MEN1 O00255 4/20 0.49
SMN1; SMN2 Q16637 4/20 0.49
RAB9A P51151 3/20 0.49
NPC1 O15118 2/20 0.49
L3MBTL1 Q9Y468 2/20 0.49
TSHR P16473 1/20 0.49
MAPT P10636 4/20 0.48
ALDH1A1 P00352 3/20 0.48
KDM4E B2RXH2 1/20 0.48
TP53 P04637 1/20 0.47
GLA P06280 1/20 0.47
PKM P14618 1/20 0.47
TDP1 Q9NUW8 1/20 0.46
POLB P06746 1/20 0.46
GAA P10253 2/20 0.46
CYP1A2 P05177 2/20 0.46
CYP2D6 P10635 2/20 0.46
CYP2C9 P11712 2/20 0.46

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
SCHEMBL6808410 0.97 F10 (0.95) F10KMT2AMEN1SMN1; SMN2RAB9A
SCHEMBL5164064 0.97 F10 (0.95) F10KMT2AMEN1SMN1; SMN2RAB9A
SCHEMBL5166204 0.94 F10 (1.00) F10KMT2AMEN1SMN1; SMN2RAB9A
SCHEMBL5165960 0.94 F10 (1.00) F10KMT2AMEN1SMN1; SMN2RAB9A
SCHEMBL5371292 0.94 F10 (0.98) F10KMT2AMEN1SMN1; SMN2RAB9A
SCHEMBL5167183 0.87 F10 (0.86) F10KMT2AMEN1SMN1; SMN2RAB9A
SCHEMBL5164562 0.87 F10 (0.86) F10KMT2AMEN1SMN1; SMN2RAB9A
SCHEMBL5166588 0.87 F10 (0.86) F10KMT2AMEN1SMN1; SMN2RAB9A
SCHEMBL6808014 0.87 F10 (0.71) F10KMT2AMEN1L3MBTL1MAPT
SCHEMBL5164649 0.86 F10 (0.85) F10KMT2AMEN1SMN1; SMN2RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040092517-A1 Phenyl derivatives and their use in the treatment of thromboembolic disorders or tumours MERCK PATENT GMBH (DE) 2004-05-13 US claimed
US-20040092517-A1 Phenyl derivatives and their use in the treatment of thromboembolic disorders or tumours MERCK PATENT GMBH (DE) 2004-05-13 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-20040092517-A1 Phenyl derivatives and their use in the treatment of thromboembolic disorders or tumours RCOR3, F2, NCOR2 F10 64/4885KMT2A 3435/4885MEN1 3442/4885

“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.