SCHEMBL12835285

SCHEMBL12835285

CCc1c(F)c(F)c(-c2ccccc2)c(F)c1F

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 2/20 0.42
ESR2 Q92731 2/20 0.42
GCGR P47871 2/20 0.41
PTGS1 P23219 1/20 0.39
PTGS2 P35354 1/20 0.39
KDM4E B2RXH2 2/20 0.38
DHFR P00374 1/20 0.38
HEXA P06865 1/20 0.38
HEXB P07686 1/20 0.38
USP7 Q93009 3/20 0.37
TP53 P04637 2/20 0.37
LMNA P02545 2/20 0.36
MAPT P10636 2/20 0.36
HTT P42858 1/20 0.36
NPC1 O15118 1/20 0.35
ALDH1A1 P00352 1/20 0.35
GAA P10253 1/20 0.35
HPGD P15428 1/20 0.35
RAB9A P51151 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35

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
SCHEMBL7711087 0.81 ALDH1A1 (0.50) ESR1ESR2DHFRLMNAMAPT
SCHEMBL28837822 0.79 USP7 (0.42) ESR1ESR2GCGRPTGS1PTGS2
SCHEMBL3960905 0.78 ALDH1A1 (0.37) DHFRLMNAMAPTHTTALDH1A1
SCHEMBL14182621 0.78 LMNA (0.48) ESR1ESR2DHFRLMNAMAPT
SCHEMBL247368 0.78 LMNA (0.48) ESR1ESR2DHFRLMNAMAPT
SCHEMBL27860186 0.77 ESR1 (0.47) ESR1ESR2GCGRPTGS1PTGS2
SCHEMBL7704707 0.76 LMNA (0.46) ESR1ESR2DHFRLMNAMAPT
SCHEMBL1179753 0.75 ALDH1A1 (0.50) ESR1ESR2DHFRLMNAMAPT
SCHEMBL13026660 0.75
SCHEMBL10880447 0.75 GCGR (0.39) GCGRDHFRLMNAMAPTHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7902363-B2 Novel air stable and solution processable n-type compounds such as n,n'-bis[3,7-dimethyl-6-octenyl]-1,7-dicyanoperylene-3,4:9,10-bis(dicarboxiamide); complementary circuits, organic light emitting diodes and photovoltaics, capacitors, sensors POLYERA CORPORATION (US) 2011-03-08 US disclosed
US-7893265-B2 Imidation of derivatives of anthracene-2,3:6,7-dianhydride, napthalene-1,4:5,8-dianhydride, or perylene-3,4:9,10-anhydride with primary amine to perylene-bis(dicarboximide)s, naphthalene-bis(dicarboximide)s, and anthracene-bis(dicarboximide)s and/or coronene-bis(dicarboximide)s; electronics, composites POLYERA CORPORATION (US) 2011-02-22 US disclosed
US-20080185577-A1 Diimide-based semiconductor materials and methods of preparing and using the same USINVEST LLC 2008-08-07 US disclosed
US-20080177073-A1 Methods for preparing arene-BIS (dicarboximide)-based semiconducting materials and related intermediates for preparing same USINVEST LLC 2008-07-24 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 (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-20080177073-A1 Methods for preparing arene-BIS (dicarboximide)-based semiconducting materials and related intermediates for preparing same RECQL, CCNE2, CCNE1 ESR1 635/4885ESR2 1530/4885GCGR 3920/4885
US-20080185577-A1 Diimide-based semiconductor materials and methods of preparing and using the same DDT, INMT, PIR ESR1 1279/4885ESR2 2742/4885GCGR 4554/4885

“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.