SCHEMBL1019465

SCHEMBL1019465

C(=Cc1ccccc1)C(C=Cc1ccccc1)=Cc1ccccc1.C=CC=CC(C=CC=C)=CC=CC=CC#N

nearest known ligand 0.32

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MCL1 Q07820 1/20 0.32
HDAC3 O15379 1/20 0.31
TNKS O95271 1/20 0.31
HDAC4 P56524 1/20 0.31
HDAC1 Q13547 1/20 0.31
HCAR2 Q8TDS4 1/20 0.31
HDAC7 Q8WUI4 1/20 0.31
HDAC2 Q92769 1/20 0.31
HDAC10 Q969S8 1/20 0.31
HDAC11 Q96DB2 1/20 0.31
HDAC8 Q9BY41 1/20 0.31
TNKS2 Q9H2K2 1/20 0.31
HDAC6 Q9UBN7 1/20 0.31
HDAC9 Q9UKV0 1/20 0.31
HDAC5 Q9UQL6 1/20 0.31
PLIN1 O60240 1/20 0.31
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2D6 P10635 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
Water SCHEMBL6447465 0.84 MAPT (0.42) HDAC3TNKSHDAC4HDAC1HCAR2
SCHEMBL2880601 0.83 MAOB (0.38) MCL1HDAC3TNKSHDAC4HDAC1
SCHEMBL11206156 0.83 LMNA (0.33) MCL1HDAC3TNKSHDAC4HDAC1
SCHEMBL258376 0.82 MCL1 (0.36) MCL1PLIN1ALDH1A1LMNAMAPT
SCHEMBL5010379 0.82 MCL1 (0.36) MCL1PLIN1ALDH1A1LMNAMAPT
SCHEMBL954016 0.82 ALDH1A1 (0.44) HDAC3TNKSHDAC4HDAC1HCAR2
SCHEMBL9422101 0.82 ALDH1A1 (0.44) HDAC3TNKSHDAC4HDAC1HCAR2
SCHEMBL24093 0.82 ALDH1A1 (0.44) HDAC3TNKSHDAC4HDAC1HCAR2
Butadiene SCHEMBL9420166 0.81 MAPT (0.42) HDAC3TNKSHDAC4HDAC1HCAR2
SCHEMBL5069733 0.78 LMNA (0.38) MCL1HDAC3TNKSHDAC4HDAC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8673272-B2 Ultraviolet-absorbing compounds ISP INVESTMENTS INC. (US) 2014-03-18 US disclosed
US-20110020251-A1 Ultraviolet-Absorbing Compounds AVOCA LLC 2011-01-27 US disclosed
EP-0578408-B1 Silicon carbide with controlled porosity CARBORUNDUM CO (US) 2000-04-19 EP disclosed
US-5869428-A CONTROLLING WEEDS ISHIHARA SANGYO KAISHA LTD. (JP) 1999-02-09 US disclosed
US-5834387-A HAVING UNIFORM DISTRIBUTION OF CONTROLLED DIAMETER PORES; FOR PUMPS OR AGITATORS, REDUCED POWER CONSUMPTION THE CARBORUNDUM COMPANY (US) 1998-11-10 US disclosed
US-5635430-A POWDER MIXTURE COMPRISING SILICON CARBIDE, BORON-AND/OR ALUMINUM-CONTAINING SINTERING AGENT, CARBON SOURCE, AND UNIFORMLY DISTRIBUTED SPHERICAL BEADS OF POLYMER FUGITIVE; FRICTION AND WEAR RESISTANCE; SINTERED SEALS THE CARBORUNDUM COMPANY (US) 1997-06-03 US disclosed
US-5589428-A Silicon carbide with controlled porosity THE CARBORUNDUM COMPANY (US) 1996-12-31 US disclosed
EP-0733629-A1 Pyridonesulfonylurea compounds, process for their production and herbicides containing them ISHIHARA SANGYO KAISHA, LTD. (JP) 1996-09-25 EP disclosed
US-5395807-A Process for making silicon carbide with controlled porosity THE CARBORUNDUM COMPANY (US) 1995-03-07 US disclosed
EP-0578408-A2 Silicon carbide with controlled porosity THE CARBORUNDUM COMPANY (US) 1994-01-12 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 (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-20110020251-A1 Ultraviolet-Absorbing Compounds UFM1, UHRF1, CUTA MCL1 3537/4885HDAC3 1506/4885TNKS 702/4885

“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.