SCHEMBL5312719

SCHEMBL5312719

[CH2]c1sc2ccccc2c1Cl

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ LOXL2 Q9Y4K0 1/20 0.53
▸ MCL1 Q07820 1/20 0.50
▸ GPR3 P46089 1/20 0.50
▸ HDAC1 Q13547 1/20 0.46
▸ HDAC8 Q9BY41 1/20 0.46
▸ HDAC6 Q9UBN7 1/20 0.46
▸ OGG1 O15527 1/20 0.44
▸ CD274 Q9NZQ7 1/20 0.41
▸ MAPT P10636 7/20 0.40
▸ KDM4E B2RXH2 6/20 0.40
▸ ALDH1A1 P00352 5/20 0.40
▸ GAA P10253 4/20 0.40
▸ RAB9A P51151 3/20 0.40
▸ MEN1 O00255 2/20 0.40
▸ KMT2A Q03164 2/20 0.40
▸ NPC1 O15118 2/20 0.40
▸ LMNA P02545 2/20 0.40
▸ HTT P42858 2/20 0.40
▸ THRB P10828 1/20 0.40
▸ RECQL P46063 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
SCHEMBL28322189 0.76 LOXL2 (0.57) LOXL2MCL1GPR3HDAC1HDAC8
SCHEMBL28375936 0.73 LOXL2 (0.53) LOXL2MCL1GPR3HDAC1HDAC8
SCHEMBL5295130 0.73 GPR3 (0.50) LOXL2GPR3MAPTKDM4EALDH1A1
SCHEMBL154877 0.73 LOXL2 (0.53) LOXL2MCL1GPR3HDAC1HDAC8
SCHEMBL28118449 0.73 LOXL2 (0.53) LOXL2MCL1GPR3HDAC1HDAC8
SCHEMBL28378900 0.73 LOXL2 (0.53) LOXL2MCL1GPR3HDAC1HDAC8
SCHEMBL28455529 0.73 MCL1 (0.60) LOXL2MCL1GPR3HDAC1HDAC8
SCHEMBL14315167 0.73 LOXL2 (0.59) LOXL2MCL1GPR3HDAC1HDAC8
SCHEMBL11959206 0.72 LOXL2 (0.69) LOXL2MCL1GPR3HDAC1HDAC8
Dibenzothiophene SCHEMBL27855215 0.72 GPR3 (0.93) LOXL2MCL1GPR3MAPTKDM4E

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
WO-2007053353-A2 PYRROLO[2,3-F] AND [3,2-F]ISOQUINOLINONE DERIVATIVES AS 5-HYDROXYTRYPTAMINE-6 LIGANDS WYETH (US) 2007-05-10 — — WO disclosed
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 LOXL2 2441/4885MCL1 4878/4885GPR3 70/4885

“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.

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