SCHEMBL18325751

SCHEMBL18325751

CCc1nc2cc(Br)cc(Cl)c2o1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PDE7B Q9NP56 3/20 0.41
GAA P10253 2/20 0.33
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP2D6 P10635 1/20 0.32
CYP2C9 P11712 1/20 0.32
CYP2C19 P33261 1/20 0.32
RXFP1 Q9HBX9 1/20 0.32
MTNR1A P48039 4/20 0.32
MTNR1B P49286 4/20 0.32
CRHR1 P34998 1/20 0.31
ALDH1A1 P00352 1/20 0.31
AKR1B1 P15121 1/20 0.31
NQO2 P16083 1/20 0.30
HTT P42858 1/20 0.30

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
SCHEMBL18317507 0.85 NOTUM (0.32) ALDH1A1AKR1B1
SCHEMBL29611877 0.85 NOTUM (0.32) ALDH1A1AKR1B1
SCHEMBL22660185 0.85 ELANE (0.36) AKR1B1
SCHEMBL16380006 0.83 MAPT (0.32) AKR1B1
SCHEMBL16379763 0.83 PDE7B (0.44) PDE7B
SCHEMBL6794737 0.80 PDE7B (0.41) PDE7BGAAMEN1KMT2AMTNR1A
SCHEMBL14758466 0.77 MAPT (0.33) GAAMEN1KMT2ACRHR1NQO2
SCHEMBL22561676 0.77 NMT1 (0.31)
SCHEMBL18317621 0.76
SCHEMBL16345619 0.75 AKR1B1 (0.36) PDE7BALDH1A1AKR1B1HTT

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-9856241-B2 Substituted benzofuranyl and benzoxazolyl compounds and uses thereof Karyopharm Therapeutics Inc. (US) 2018-01-02 US disclosed
US-20160368904-A1 SUBSTITUTED BENZOFURANYL AND BENZOXAZOLYL COMPOUNDS AND USES THEREOF Karyopharm Therapeutics Inc. 2016-12-22 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-20160368904-A1 SUBSTITUTED BENZOFURANYL AND BENZOXAZOLYL COMPOUNDS AND USES THEREOF BCL6, MALT1, BTK PDE7B 4068/4885GAA 1688/4885MEN1 1429/4885

“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.