SCHEMBL987554

SCHEMBL987554

C1=CC2=Cc3c(ccc4ccccc34)C2C=C1

nearest known ligand 0.34

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.34
HSD17B10 Q99714 4/20 0.34
CYP2A6 P11509 2/20 0.34
TSHR P16473 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
KDM4E B2RXH2 1/20 0.34
HPRT1 P00492 1/20 0.32
CYP1A2 P05177 2/20 0.31
HPGD P15428 2/20 0.31
KDM1A O60341 1/20 0.31
HIF1A Q16665 1/20 0.31
CYP1B1 Q16678 1/20 0.31
THRB P10828 1/20 0.31
CA12 O43570 1/20 0.30
CA9 Q16790 1/20 0.30
P2RX4 Q99571 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
SCHEMBL5476593 0.77 CYP1A2 (0.41) ALDH1A1HSD17B10CYP1A2HPGDTHRB
SCHEMBL10771985 0.71 CA12 (0.37) ALDH1A1HSD17B10CYP2A6TSHRTDP1
Hydrochloric Acid SCHEMBL7926686 0.70 KDM4E (0.32) ALDH1A1HSD17B10CYP2A6TSHRTDP1
SCHEMBL13837563 0.69 ALDH1A1 (0.35) ALDH1A1HSD17B10CYP2A6TSHRTDP1
SCHEMBL7138158 0.68 MEN1 (0.39)
SCHEMBL886981 0.68 ALDH1A1 (0.34) ALDH1A1HSD17B10CYP2A6TSHRTDP1
SCHEMBL13320405 0.68 ALDH1A1 (0.34) ALDH1A1HSD17B10CYP2A6TSHRTDP1
SCHEMBL28610364 0.67 MTNR1A (0.41) ALDH1A1HSD17B10KDM4EHPGDKDM1A
SCHEMBL672770 0.67 ALDH1A1 (0.37) ALDH1A1HSD17B10CYP2A6TSHRTDP1
SCHEMBL20548576 0.64 P2RX4 (0.38) ALDH1A1HSD17B10CYP2A6TSHRTDP1

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 99 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4252287-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES Merck Patent GmbH (DE) 2023-10-04 EP claimed
WO-2023139034-A1 ORGANIC ELECTRIC ELEMENT WITH MIXED HOST SYSTEM MERCK PATENT GMBH (DE) 2023-07-27 WO claimed
EP-4186113-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES Merck Patent GmbH (DE) 2023-05-31 EP claimed
WO-2022112541-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES MERCK PATENT GMBH (DE) 2022-06-02 WO claimed
WO-2010115498-A1 ORGANIC ELECTROLUMINESCENCE DEVICE MERCK PATENT GMBH (DE) 2010-10-14 WO claimed
EP-4399952-A1 ELECTRONIC DEVICE Merck Patent GmbH (DE) 2024-07-17 EP disclosed
WO-2024126322-A1 MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2024-06-20 WO disclosed
WO-2024013276-A1 MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2024-01-18 WO disclosed
WO-2024013275-A1 MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2024-01-18 WO disclosed
WO-2024002629-A1 COMPOUNDS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2024-01-04 WO disclosed
EP-4263512-A1 MATERIALS FOR ELECTRONIC DEVICES Merck Patent GmbH (DE) 2023-10-25 EP disclosed
EP-4252287-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENT DEVICES Merck Patent GmbH (DE) 2023-10-04 EP disclosed
EP-2303814-A1 COMPOUNDS FOR ELECTRONIC DEVICES Merck Patent GmbH (DE) 2011-04-06 EP disclosed
WO-2011006568-A1 MATERIALS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2011-01-20 WO disclosed
WO-2010115498-A1 ORGANIC ELECTROLUMINESCENCE DEVICE MERCK PATENT GMBH (DE) 2010-10-14 WO disclosed
WO-2010102706-A1 ORGANIC ELECTROLUMINESCENCE DEVICE MERCK PATENT GMBH (DE) 2010-09-16 WO disclosed
WO-2010012328-A1 COMPOUNDS FOR ELECTRONIC DEVICES MERCK PATENT GMBH (DE) 2010-02-04 WO disclosed
WO-2010006680-A1 MATERIALS FOR ORGANIC ELECTROLUMINESCENCE DEVICES MERCK PATENT GMBH (DE) 2010-01-21 WO disclosed
US-7166684-B2 Transition metal compound, catalyst for olefin polymerization and method for producing polyolefin JAPAN POLYETHYLENE CORPORATION (JP) 2007-01-23 US disclosed
US-20060167196-A1 Novel transition metal compound, catalyst for olefin polymerization and method for producing polyolefin JAPAN POLYETHYLENE CORPORATION (JP) 2006-07-27 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-20060167196-A1 Novel transition metal compound, catalyst for olefin polymerization and method for producing polyolefin PCLAF, ZKSCAN2, POF1B ALDH1A1 2910/4885HSD17B10 2089/4885CYP2A6 2184/4885

“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.