SCHEMBL5654201

SCHEMBL5654201

NCCn1ccc2ccc3c(=O)n(Cc4cccc(Cl)c4)ccc3c21

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
EGLN1 Q9GZT9 1/20 0.47
MAPT P10636 2/20 0.45
TP53 P04637 1/20 0.45
LMNA P02545 2/20 0.44
POLB P06746 2/20 0.44
RECQL P46063 1/20 0.44
ALDH1A1 P00352 1/20 0.43
SMN1; SMN2 Q16637 3/20 0.42
KDM4E B2RXH2 1/20 0.42
MAOB P27338 4/20 0.41
HTR6 P50406 3/20 0.41
HTT P42858 2/20 0.41
GLA P06280 1/20 0.41
UBE2N P61088 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
KMT2A Q03164 1/20 0.41
THRB P10828 1/20 0.40
DBH P09172 1/20 0.40
FSCN1 Q16658 1/20 0.40

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
SCHEMBL5314553 0.88 DHPS (0.44) EGLN1MAPTLMNAALDH1A1KDM4E
Hydrochloric Acid SCHEMBL5656624 0.87 DHPS (0.43) EGLN1MAPTLMNAALDH1A1KDM4E
SCHEMBL5332356 0.80 GRM2 (0.44) MAPTLMNAALDH1A1SMN1; SMN2KDM4E
SCHEMBL5314946 0.74 LOXL2 (0.43) MAPTTP53ALDH1A1KDM4EHTR6
SCHEMBL6171027 0.74 EGLN1 (0.53) EGLN1MAPTTP53LMNAPOLB
SCHEMBL5314950 0.74 HTR2A (0.44) EGLN1HTR6
Hydrochloric Acid SCHEMBL5655466 0.73 HTR2A (0.43) EGLN1HTR6
SCHEMBL5655496 0.71 DYRK1A (0.41) HTR6
SCHEMBL2611357 0.69 EGLN1 (0.50) EGLN1MAPTTP53LMNAPOLB
SCHEMBL5696907 0.68 MMP13 (0.68) EGLN1MAPTTP53LMNAPOLB

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-20070099912-A1 Pyrrolo[2,3-F] and [3,2-F]Isoquinolinone derivatives as 5-hydroxytryptamine-6 ligands WYETH (US) 2007-05-03 US claimed
US-20070099912-A1 Pyrrolo[2,3-F] and [3,2-F]Isoquinolinone derivatives as 5-hydroxytryptamine-6 ligands WYETH (US) 2007-05-03 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-20070099912-A1 Pyrrolo[2,3-F] and [3,2-F]Isoquinolinone derivatives as 5-hydroxytryptamine-6 ligands HTR2C, HTR5A, HTR6 EGLN1 2592/4885MAPT 1263/4885TP53 4774/4885

“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.