SCHEMBL4333712

SCHEMBL4333712

CN(C)c1ccc2c(c1)OC(N)=C(C#N)C2c1ccc(C(F)(F)F)cc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 11/20 0.68
KMT2A Q03164 11/20 0.68
MAPT P10636 8/20 0.68
LMNA P02545 7/20 0.68
NPSR1 Q6W5P4 6/20 0.68
ALOX15 P16050 5/20 0.68
TSHR P16473 5/20 0.68
CASP1 P29466 5/20 0.68
HTT P42858 4/20 0.68
GAA P10253 4/20 0.68
MAPK1 P28482 3/20 0.68
TP53 P04637 3/20 0.68
CASP7 P55210 3/20 0.68
USP2 O75604 2/20 0.68
TUBB4A P04350 2/20 0.57
TUBB P07437 2/20 0.57
TUBA3C P0DPH7 2/20 0.57
TUBA1B P68363 2/20 0.57
TUBA4A P68366 2/20 0.57
TUBB4B P68371 2/20 0.57

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
SCHEMBL4327837 0.91 MEN1 (0.68) MEN1KMT2AMAPTLMNANPSR1
SCHEMBL4323944 0.90 MEN1 (0.66) MEN1KMT2AMAPTLMNANPSR1
SCHEMBL30299230 0.89 MEN1 (0.75) MEN1KMT2AMAPTLMNANPSR1
SCHEMBL4327759 0.89 MEN1 (0.75) MEN1KMT2AMAPTLMNANPSR1
SCHEMBL30628028 0.87 MEN1 (0.79) MEN1KMT2AMAPTLMNANPSR1
SCHEMBL28650070 0.87 MEN1 (0.79) MEN1KMT2AMAPTLMNANPSR1
SCHEMBL30628022 0.86 POLB (0.73) MEN1KMT2AMAPTLMNANPSR1
SCHEMBL28644827 0.86 POLB (0.73) MEN1KMT2AMAPTLMNANPSR1
SCHEMBL28927732 0.86 MEN1 (0.70) MEN1KMT2AMAPTLMNANPSR1
SCHEMBL30628023 0.86 MEN1 (0.70) MEN1KMT2AMAPTLMNANPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7507762-B2 Substituted 4H-chromene and analogs as activators of caspases and inducers of apoptosis and the use thereof CYTOVIA, INC. (US) 2009-03-24 US claimed
US-20050154015-A1 Substituted 4H-chromene and analogs as activators of caspases and inducers of apoptosis and the use thereof CYTOVIA, INC. (US) 2005-07-14 US claimed
EP-1230232-B1 SUBSTITUTED 4H-CHROMENE AND ANALOGS AS ACTIVATORS OF CASPASES AND INDUCERS OF APOPTOSIS AND THE USE THEREOF CYTOVIA INC (US) 2004-02-25 EP claimed
US-7507762-B2 Substituted 4H-chromene and analogs as activators of caspases and inducers of apoptosis and the use thereof CYTOVIA, INC. (US) 2009-03-24 US disclosed
US-20050154015-A1 Substituted 4H-chromene and analogs as activators of caspases and inducers of apoptosis and the use thereof CYTOVIA, INC. (US) 2005-07-14 US disclosed
US-6906203-B1 Substituted 4H-chromene and analogs as activators of caspases and inducers of apoptosis and the use thereof CYTOVIA, INC. (US) 2005-06-14 US disclosed
EP-1230232-B1 SUBSTITUTED 4H-CHROMENE AND ANALOGS AS ACTIVATORS OF CASPASES AND INDUCERS OF APOPTOSIS AND THE USE THEREOF CYTOVIA INC (US) 2004-02-25 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-20050154015-A1 Substituted 4H-chromene and analogs as activators of caspases and inducers of apoptosis and the use thereof CASP4, CASP3, CASP5 MEN1 2868/4885KMT2A 3138/4885MAPT 4779/4885

“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.