SCHEMBL6909323

SCHEMBL6909323

COC1=CCc2ccccc21

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDC25A P30304 3/20 0.38
CDC25B P30305 3/20 0.38
PTPN1 P18031 1/20 0.38
IDO1 P14902 1/20 0.38
HTR6 P50406 1/20 0.37
PTGS2 P35354 1/20 0.37
RAB9A P51151 5/20 0.37
MAPT P10636 5/20 0.37
SMN1; SMN2 Q16637 4/20 0.37
KDM4E B2RXH2 4/20 0.37
ALDH1A1 P00352 4/20 0.37
HPGD P15428 2/20 0.37
TDP1 Q9NUW8 2/20 0.37
MAP2K7 O14733 1/20 0.37
GMNN O75496 1/20 0.37
LMNA P02545 1/20 0.37
TP53 P04637 1/20 0.37
CYP1A2 P05177 1/20 0.37
POLB P06746 1/20 0.37
CYP3A4 P08684 1/20 0.37

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
SCHEMBL7113360 0.84 CDC25A (0.50) CDC25ACDC25BPTPN1IDO1RAB9A
SCHEMBL23234268 0.80 ALDH1A1 (0.43) RAB9AMAPTKDM4EALDH1A1HPGD
SCHEMBL6161470 0.79 CES1 (0.39) CDC25ACDC25BPTPN1IDO1PTGS2
SCHEMBL25176054 0.79 PTPRC (0.44) CDC25BHTR6RAB9AMAPTSMN1; SMN2
SCHEMBL4618562 0.78 HTR6 (0.37) HTR6MAPTALDH1A1HPGDCYP1A2
SCHEMBL7614983 0.78 HTR6 (0.34) HTR6
SCHEMBL14825946 0.76 L3MBTL1 (0.42) RAB9AMAPTSMN1; SMN2ALDH1A1HPGD
SCHEMBL5393252 0.76 MAPT (0.35) CDC25ACDC25BPTPN1IDO1RAB9A
SCHEMBL10028290 0.75 PTPN1 (0.48) CDC25ACDC25BPTPN1IDO1PTGS2
SCHEMBL7633782 0.75 ALDH1A1 (0.41) PTGS2MAPTSMN1; SMN2KDM4EALDH1A1

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 11 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12030896-B2 PIKfyve inhibitors MAYO FOUNDATION FOR MEDICAL EDUCATION AND RESEARCH (US) 2024-07-09 US disclosed
US-9156827-B2 Anticancer agent THE UNIVERSITY OF TOKYO (JP) 2015-10-13 US disclosed
US-20130102776-A1 ANTICANCER AGENT RIKEN (JP) 2013-04-25 US disclosed
EP-0923589-B1 3-HETEROATOM SUBSTITUTED CYCLOPENTADIENYL-CONTAINING METAL COMPLEXES AND OLEFIN POLYMERIZATION PROCESS DOW GLOBAL TECHNOLOGIES INC (US) 2004-09-15 EP disclosed
US-6268444-B1 TITANIUM, ZIRCONIUM OR HAFNIUM COMPOUNDS FOR POLYMERIZATION DOW CHEMICAL COMPANY 2001-07-31 US disclosed
US-6087292-A Metallocene catalysts comprising indenyl ligands substituted with electronegative groups TANGOR GMBH (DE) 2000-07-11 US disclosed
EP-0923589-A1 3-HETEROATOM SUBSTITUTED CYCLOPENTADIENYL-CONTAINING METAL COMPLEXES AND OLEFIN POLYMERIZATION PROCESS THE DOW CHEMICAL COMPANY (US) 1999-06-23 EP disclosed
US-5763542-A Process for the preparation of an olefin polymer using specific metallocenes TARGOR GMBH (DE) 1998-06-09 US disclosed
WO-1998006727-A1 3-HETEROATOM SUBSTITUTED CYCLOPENTADIENYL-CONTAINING METAL COMPLEXES AND OLEFIN POLYMERIZATION PROCESS THE DOW CHEMICAL COMPANY (US) 1998-02-19 WO disclosed
US-5504232-A Process for the preparation of an olefin polymer using specific metallocenes HOECHST AKTIENGESELLSCHAFT (DE) 1996-04-02 US disclosed
EP-0582195-A1 Process for the preparation of polymers using specific metallocenes HOECHST AKTIENGESELLSCHAFT (DE) 1994-02-09 EP 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 (2 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-12030896-B2 PIKfyve inhibitors PIKFYVE, PIP4K2B, PIP4K2A CDC25A 548/4885CDC25B 990/4885PTPN1 222/4885
US-20130102776-A1 ANTICANCER AGENT PIM1, PIM3, PIM2 CDC25A 381/4885CDC25B 1004/4885PTPN1 1361/4885

“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.