SCHEMBL18101368

SCHEMBL18101368

Brc1ccc(-c2cc3c4ccccc4n(-c4ccc5ccccc5c4)c3c3c2sc2ccccc23)cc1

nearest known ligand 0.36

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ PMM2 O15305 1/20 0.36
▸ MPI P34949 1/20 0.36
▸ PHOSPHO1 Q8TCT1 1/20 0.36
▸ PTPN1 P18031 1/20 0.31
▸ RXFP1 Q9HBX9 1/20 0.31

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
SCHEMBL18101421 0.90 PMM2 (0.34) PMM2MPIPHOSPHO1
SCHEMBL18101417 0.89 ALDH1A1 (0.32) PTPN1RXFP1
SCHEMBL18101307 0.89 PTPN1 (0.31) PTPN1RXFP1
SCHEMBL20175574 0.89 PMM2 (0.36) PMM2MPIPHOSPHO1
SCHEMBL18101366 0.89 KDM4E (0.33) PTPN1RXFP1
SCHEMBL18101195 0.88 ATM (0.38) PTPN1RXFP1
SCHEMBL20175587 0.88 PMM2 (0.36) PMM2MPIPHOSPHO1
SCHEMBL18101168 0.86 PMM2 (0.33) PMM2MPIPHOSPHO1
SCHEMBL20175568 0.86 KDM4E (0.35) PMM2MPIPHOSPHO1
SCHEMBL20175562 0.86 KDM4E (0.35) PMM2MPIPHOSPHO1

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-20180201621-A1 COMPOUND FOR ORGANIC ELECTRIC ELEMENT, ORGANIC ELECTRIC ELEMENT COMPRISING THE SAME AND ELECTRONIC DEVICE THEREOF DUK SAN NEOLUX CO., LTD. (KR) 2018-07-19 — — US disclosed
WO-2016153198-A1 COMPOUND FOR ORGANIC ELECTRONIC DEVICE, ORGANIC ELECTRONIC DEVICE USING SAME, AND ELECTRONIC APPARATUS THEREOF 덕산네오룩스 주식회사 2016-09-29 — — WO 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-20180201621-A1 COMPOUND FOR ORGANIC ELECTRIC ELEMENT, ORGANIC ELECTRIC ELEMENT COMPRISING THE SAME AND ELECTRONIC DEVICE THEREOF PIEZO1, OCIAD1, LEF1 PMM2 3201/4885MPI 4055/4885PHOSPHO1 678/4885

“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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