SCHEMBL6765980

SCHEMBL6765980

CCOCCCNC(=O)c1ccc(C(=O)Nc2ccccc2N)s1

nearest known ligand 0.55

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HPGD P15428 4/20 0.49
HTT P42858 1/20 0.49
RAB9A P51151 2/20 0.48
POLB P06746 1/20 0.48
KMT2A Q03164 1/20 0.48
HDAC3 O15379 8/20 0.47
HDAC1 Q13547 7/20 0.47
NPC1 O15118 2/20 0.45
SMN1; SMN2 Q16637 2/20 0.45
TP53 P04637 1/20 0.45
RXFP1 Q9HBX9 1/20 0.45
HDAC2 Q92769 1/20 0.45
NCOR2 Q9Y618 1/20 0.45

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
SCHEMBL6389216 0.90 GAA (0.52) HPGDHDAC3HDAC1SMN1; SMN2HDAC2
SCHEMBL4483167 0.85 HPGD (0.61) HPGDRAB9AKMT2AHDAC3HDAC1
SCHEMBL6385728 0.82 ACKR3 (0.53) HPGDKMT2AHDAC3HDAC1HDAC2
SCHEMBL6384340 0.81 HDAC3 (0.49) HDAC3HDAC1HDAC2NCOR2
SCHEMBL6385892 0.81 ACKR3 (0.54) RAB9AKMT2AHDAC3HDAC1TP53
SCHEMBL6762618 0.81 HDAC1 (0.48) HDAC3HDAC1HDAC2NCOR2
SCHEMBL6383652 0.79 HDAC1 (0.48) HPGDHTTRAB9APOLBKMT2A
SCHEMBL6384887 0.79 MAPK1 (0.56) HPGDHTTHDAC3HDAC1HDAC2
SCHEMBL6076439 0.76 HDAC1 (0.60) HDAC3HDAC1HDAC2NCOR2
SCHEMBL6759168 0.76 LMNA (0.47) HPGDKMT2AHDAC3HDAC1SMN1; SMN2

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-20040162317-A1 Mono-acylated o-phenylendiamines derivatives F. HOFFMANN-LA ROCHE AG, A SWISS COMPANY (CH) 2004-08-19 US claimed

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-20040162317-A1 Mono-acylated o-phenylendiamines derivatives HDAC1, HDAC11, HDAC10 HPGD 1098/4885HTT 2099/4885RAB9A 2081/4885

“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.