SCHEMBL19845435

SCHEMBL19845435

CC1(C)c2ccccc2-c2ccc(-c3ccc4c(c3)c3ccccc3n4-c3cccc(-c4cc(-c5cccc(-c6ccc(-c7ccccc7)cc6)c5)nc(-n5c6ccccc6c6cc(-c7ccc8c(c7)C(C)(C)c7ccccc7-8)ccc65)n4)c3)cc21

nearest known ligand 0.32

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ PDE10A Q9Y233 1/20 0.32
▸ PDK2 Q15119 2/20 0.32
▸ KDM4E B2RXH2 2/20 0.32
▸ ATM Q13315 1/20 0.32
▸ L3MBTL1 Q9Y468 1/20 0.32
▸ TSPO P30536 1/20 0.31
▸ PTGER4 P35408 1/20 0.31
▸ PTGES O14684 1/20 0.31
▸ CAMK2D Q13557 1/20 0.30
▸ NPY5R Q15761 1/20 0.30
▸ ALDH1A1 P00352 1/20 0.30
▸ HPGD P15428 1/20 0.30
▸ TSHR P16473 1/20 0.30
▸ MAPK1 P28482 1/20 0.30
▸ CASP1 P29466 1/20 0.30
▸ CASP7 P55210 1/20 0.30
▸ SMN1; SMN2 Q16637 1/20 0.30
▸ HSD17B10 Q99714 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
SCHEMBL19845433 1.00 PDE10A (0.32) PDE10APDK2KDM4EATML3MBTL1
SCHEMBL19845430 0.99 PDE10A (0.32) PDE10APDK2KDM4EATML3MBTL1
SCHEMBL19845692 0.97 PDE10A (0.31) PDE10APDK2TSPO
SCHEMBL19845431 0.96 KDM4E (0.30) KDM4EATML3MBTL1PTGER4PTGES
SCHEMBL19845674 0.96 PDK2 (0.33) PDE10APDK2KDM4EALDH1A1HPGD
SCHEMBL19845432 0.95 — —
SCHEMBL18385435 0.95 KDM4E (0.31) PDE10AKDM4EATML3MBTL1PTGER4
SCHEMBL18385460 0.95 KDM4E (0.31) PDE10AKDM4EATML3MBTL1PTGER4
SCHEMBL18385444 0.95 KDM4E (0.31) PDE10AKDM4EATML3MBTL1PTGER4
SCHEMBL18385453 0.95 KDM4E (0.31) PDE10AKDM4EATML3MBTL1PTGER4

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-20180037574-A1 COMPOUND, COMPOSITION, ORGANIC ELECTROLUMINESCENCE ELEMENT, AND ELECTRONIC DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2018-02-08 — — US disclosed
US-20180037574-A1 COMPOUND, COMPOSITION, ORGANIC ELECTROLUMINESCENCE ELEMENT, AND ELECTRONIC DEVICE IDEMITSU KOSAN CO., LTD. (JP) 2018-02-08 — — 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-20180037574-A1 COMPOUND, COMPOSITION, ORGANIC ELECTROLUMINESCENCE ELEMENT, AND ELECTRONIC DEVICE PIEZO1, ETV6, LEF1 PDE10A 1913/4885PDK2 2616/4885KDM4E 2538/4885

“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.

Send feedback