SCHEMBL6328529

SCHEMBL6328529

O=C1Cc2c(cccc2-c2cccc(-c3ccccc3)c2)N1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 2/20 0.54
CREBBP Q92793 2/20 0.54
PIP4K2A P48426 1/20 0.53
PIP4K2B P78356 1/20 0.53
ABL1 P00519 1/20 0.49
TDP2 O95551 2/20 0.49
GRIA1 P42261 1/20 0.48
CACNG8 Q8WXS5 1/20 0.48
AHR P35869 1/20 0.47
PDK2 Q15119 1/20 0.47
JAK2 O60674 1/20 0.47
CCNB2 O95067 6/20 0.46
CDK1 P06493 6/20 0.46
CCNB1 P14635 6/20 0.46
GSK3B P49841 6/20 0.46
CCNB3 Q8WWL7 6/20 0.46
CDK5 Q00535 5/20 0.46
CDK5R1 Q15078 5/20 0.46
YAP1 P46937 1/20 0.46
PGR P06401 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
SCHEMBL16090379 0.90 BRD4 (0.52) BRD4CREBBPPIP4K2APIP4K2BABL1
SCHEMBL5843496 0.90 JAK2 (0.51) BRD4CREBBPPIP4K2APIP4K2BABL1
SCHEMBL6323945 0.84 JAK2 (0.49) BRD4CREBBPPIP4K2APIP4K2BABL1
SCHEMBL155873 0.83 GSK3B (0.50) BRD4CREBBPPIP4K2APIP4K2BABL1
SCHEMBL6321593 0.83 TDP2 (0.52) PIP4K2APIP4K2BABL1TDP2AHR
SCHEMBL10712645 0.83 TDP2 (0.52) PIP4K2APIP4K2BABL1TDP2GRIA1
SCHEMBL6319680 0.83 PGR (0.58) PIP4K2APIP4K2BABL1TDP2AHR
SCHEMBL6320773 0.82 TDP2 (0.55) BRD4CREBBPPIP4K2APIP4K2BABL1
SCHEMBL6320969 0.80 GSK3B (0.53) PIP4K2APIP4K2BABL1TDP2CCNB2
SCHEMBL6321744 0.80 JAK2 (0.55) BRD4CREBBPPIP4K2APIP4K2BABL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6861418-B2 4-aryl substituted indolinones SUGEN, INC. (US) 2005-03-01 US disclosed
US-20040157909-A1 4-Aryl substituted indolinones SUGEN, INC. 2004-08-12 US disclosed
US-6677368-B2 4-aryl substituted indolinones SUGEN, INC. 2004-01-13 US disclosed
EP-1349852-A2 4-(HETERO)ARYL SUBSTITUTED INDOLINONES Sugen, Inc. (US) 2003-10-08 EP disclosed
US-20030069297-A1 4-aryl substituted indolinones SUGEN, INC. 2003-04-10 US disclosed
WO-2002055517-A2 4-(HETERO)ARYL SUBSTITUTED INDOLINONES CUI JINGRONG (US) 2002-07-18 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 (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-20030069297-A1 4-aryl substituted indolinones CDK5, CAMK4, TNK2 BRD4 180/4885CREBBP 174/4885PIP4K2A 373/4885
US-20040157909-A1 4-Aryl substituted indolinones CDK5, CAMK4, TNK2 BRD4 180/4885CREBBP 174/4885PIP4K2A 373/4885

“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.