SCHEMBL4319987

SCHEMBL4319987

Cn1ccc2c3c(ccc21)C(c1ccc(C#N)cc1)C(C#N)=C(N)O3

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MYB P10242 12/20 0.61
MAPT P10636 5/20 0.43
MEN1 O00255 4/20 0.43
KMT2A Q03164 4/20 0.43
KDM4E B2RXH2 4/20 0.43
POLB P06746 4/20 0.43
L3MBTL1 Q9Y468 3/20 0.43
ALDH1A1 P00352 3/20 0.43
ALOX15 P16050 3/20 0.43
HSD17B10 Q99714 3/20 0.43
LMNA P02545 2/20 0.43
CASP1 P29466 2/20 0.43
HPGD P15428 2/20 0.43
ALOX12 P18054 2/20 0.43
USP2 O75604 1/20 0.43
PKM P14618 1/20 0.43
CASP7 P55210 1/20 0.43
GAA P10253 2/20 0.43
NPSR1 Q6W5P4 1/20 0.43
RAB9A P51151 1/20 0.42

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
SCHEMBL4329071 0.90 MYB (0.54) MYBMAPTMEN1KMT2AKDM4E
SCHEMBL4328192 0.88 MYB (0.50) MYBMAPTMEN1KMT2AKDM4E
SCHEMBL4328266 0.85 MYB (0.45) MYBMAPTMEN1KMT2AKDM4E
SCHEMBL4320218 0.85 MYB (0.53) MYBMAPTMEN1KMT2AKDM4E
SCHEMBL4329068 0.85 MYB (0.53) MYBMEN1KMT2A
SCHEMBL4320003 0.84 MYB (0.51) MYBMAPTMEN1KMT2AKDM4E
SCHEMBL4332182 0.84 MYB (0.46) MYBMAPTMEN1KMT2AKDM4E
SCHEMBL4331099 0.83 MYB (0.49) MYBMAPTMEN1KMT2AKDM4E
SCHEMBL4334348 0.83 MEN1 (0.55) MYBMAPTMEN1KMT2AKDM4E
SCHEMBL4343035 0.83 MYB (0.53) MYBHSD17B10MAPK1

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-7528164-B2 Substituted 4-aryl-4h-pyrrolo[2,3-h]chromenes and analogs as activators of caspases and inducers of apoptosis and the use thereof CYTOVIA, INC. (US) 2009-05-05 US claimed
US-20060104998-A1 Substituted 4-aryl-4h-pyrrolo[2,3-h]chromenes and analogs as activators of caspases and inducers of apoptosis and the use thereof CYTOVIA, INC. (US) 2006-05-18 US claimed
US-7528164-B2 Substituted 4-aryl-4h-pyrrolo[2,3-h]chromenes and analogs as activators of caspases and inducers of apoptosis and the use thereof CYTOVIA, INC. (US) 2009-05-05 US disclosed
US-20060104998-A1 Substituted 4-aryl-4h-pyrrolo[2,3-h]chromenes and analogs as activators of caspases and inducers of apoptosis and the use thereof CYTOVIA, INC. (US) 2006-05-18 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-20060104998-A1 Substituted 4-aryl-4h-pyrrolo[2,3-h]chromenes and analogs as activators of caspases and inducers of apoptosis and the use thereof CASP3, CASP4, CASP2 MYB 326/4885MAPT 4700/4885MEN1 4060/4885

“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.