SCHEMBL8356629

SCHEMBL8356629

COC(=O)c1cn(C)c2ccc(Cl)cc12

nearest known ligand 0.64

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NR4A2 P43354 10/20 0.64
ABL1 P00519 1/20 0.50
BRD4 O60885 1/20 0.50
KMT2A Q03164 3/20 0.49
LMNA P02545 2/20 0.48
MEN1 O00255 1/20 0.48
ALDH1A1 P00352 1/20 0.48
HPGD P15428 1/20 0.48
RECQL P46063 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48
KDM4E B2RXH2 2/20 0.48
POLB P06746 1/20 0.48
CYP1A2 P05177 1/20 0.48
CYP2C19 P33261 1/20 0.48
GAA P10253 1/20 0.46

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
SCHEMBL8245425 0.85 NR4A2 (0.48) NR4A2KMT2AALDH1A1SMN1; SMN2KDM4E
SCHEMBL9572754 0.83 KCNH2 (0.59) NR4A2BRD4KMT2ALMNAMEN1
SCHEMBL8355113 0.83 KMT2A (0.63) NR4A2KMT2AMEN1ALDH1A1SMN1; SMN2
SCHEMBL29263733 0.82 NR4A2 (0.64) NR4A2BRD4KMT2ALMNAMEN1
SCHEMBL13415459 0.82 NR4A2 (0.64) NR4A2BRD4KMT2AKDM4E
SCHEMBL7985067 0.82 NR4A2 (0.64) NR4A2ALDH1A1
SCHEMBL19202547 0.82 NR4A2 (0.64) NR4A2BRD4KMT2ALMNAMEN1
SCHEMBL13114466 0.81 KDM4E (0.64) NR4A2KMT2ALMNAMEN1ALDH1A1
SCHEMBL13415462 0.81 ALDH1A1 (0.49) NR4A2KMT2AALDH1A1SMN1; SMN2KDM4E
SCHEMBL6590142 0.81 MAPT (0.51) NR4A2KMT2ALMNAALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2061759-B1 CYCLIC MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY BRISTOL MYERS SQUIBB CO (US) 2013-03-27 EP disclosed
US-8324251-B2 Cyclic modulators of chemokine receptor activity BRISTOL-MYERS SQUIBB COMPANY (US) 2012-12-04 US disclosed
US-8324251-B2 Cyclic modulators of chemokine receptor activity BRISTOL-MYERS SQUIBB COMPANY (US) 2012-12-04 US disclosed
US-20100093798-A1 CYCLIC MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY BRISTOL-MYERS SQUIBB COMPANY 2010-04-15 US disclosed
US-20100093798-A1 CYCLIC MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY BRISTOL-MYERS SQUIBB COMPANY 2010-04-15 US disclosed
WO-2008042926-A1 CYCLIC MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY BRISTOL-MYERS SQUIBB COMPANY (US) 2008-04-10 WO disclosed
US-5877202-A Indole derivatives useful to treat estrogen-related neoplasms and disorders AVENTISUB II INC. 1999-03-02 US disclosed
EP-0746544-B1 NOVEL INDOLE DERIVATIVES USEFUL TO TREAT ESTROGEN-RELATED NEOPLASMS AND DISORDERS MERRELL PHARMA INC (US) 1998-09-09 EP disclosed
CN-1141627-A Indole derivatives for the treatment of estrogen-related tumors and diseases MERRELL DOW PHARMA (US) 1997-01-29 CN disclosed
EP-0746544-A1 NOVEL INDOLE DERIVATIVES USEFUL TO TREAT ESTROGEN-RELATED NEOPLASMS AND DISORDERS MERRELL PHARMACEUTICALS INC. (US) 1996-12-11 EP disclosed
WO-1995022524-A1 NOVEL INDOLE DERIVATIVES USEFUL TO TREAT ESTROGEN-RELATED NEOPLASMS AND DISORDERS MERRELL PHARMACEUTICALS INC. (US) 1995-08-24 WO 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-20100093798-A1 CYCLIC MODULATORS OF CHEMOKINE RECEPTOR ACTIVITY CCR1, CXCR1, CCR3 NR4A2 561/4885ABL1 4269/4885BRD4 3193/4885

“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.