SCHEMBL24588656

SCHEMBL24588656

Clc1cc2c3ccccc3sc2c2sc3ccccc3c12

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GPR3 P46089 1/20 0.48
MAPT P10636 3/20 0.45
TNKS O95271 2/20 0.41
TNKS2 Q9H2K2 2/20 0.41
PTPN1 P18031 3/20 0.41
RAB9A P51151 3/20 0.41
ALDH1A1 P00352 3/20 0.41
KDM4E B2RXH2 3/20 0.41
L3MBTL1 Q9Y468 2/20 0.41
ATM Q13315 1/20 0.41
HPGD P15428 2/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
LOXL2 Q9Y4K0 1/20 0.39
ALOX5 P09917 1/20 0.38
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
CDK4 P11802 1/20 0.38
CCND1 P24385 1/20 0.38
MAP3K9 P80192 1/20 0.38
MAP3K11 Q16584 1/20 0.38

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
SCHEMBL24588630 0.87 GPR3 (0.46) GPR3MAPTTNKSTNKS2PTPN1
SCHEMBL24889416 0.82 GPR3 (0.50) GPR3MAPTTNKSTNKS2RAB9A
SCHEMBL24589044 0.81 GPR3 (0.48) GPR3MAPTTNKSTNKS2PTPN1
SCHEMBL22172094 0.79 PTPN1 (0.50) GPR3MAPTTNKSTNKS2PTPN1
SCHEMBL24295940 0.79 GPR3 (0.41) GPR3MAPTTNKSTNKS2PTPN1
SCHEMBL24588624 0.78 GPR3 (0.50) GPR3MAPTTNKSTNKS2PTPN1
SCHEMBL23690473 0.78 GPR3 (0.40) GPR3MAPTTNKSTNKS2PTPN1
SCHEMBL23690474 0.78 MAPT (0.42) GPR3MAPTTNKSTNKS2PTPN1
SCHEMBL21224252 0.77 GPR3 (0.48) GPR3MAPTTNKSTNKS2RAB9A
SCHEMBL22012010 0.77 GPR3 (0.57) GPR3MAPTTNKSTNKS2PTPN1

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-20220209139-A1 ORGANIC METAL COMPOUND, ORGANIC LIGHT EMITTING DIODE AND ORGANIC LIGHT EMITTING DEVICE HAVING THE COMPOUND LG DISPLAY CO., LTD (KR) 2022-06-30 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-20220209139-A1 ORGANIC METAL COMPOUND, ORGANIC LIGHT EMITTING DIODE AND ORGANIC LIGHT EMITTING DEVICE HAVING THE COMPOUND OCIAD1, OCIAD2, OLA1 GPR3 4572/4885MAPT 913/4885TNKS 3852/4885

“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.