SCHEMBL4769376

SCHEMBL4769376

CN(C)Cc1ccc(-c2cc3c(Nc4cccc(Cl)c4)ncnc3[nH]2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BRAF P15056 5/20 0.51
TNNI3K Q59H18 5/20 0.51
TTBK1 Q5TCY1 1/20 0.50
TTBK2 Q6IQ55 1/20 0.50
EGFR P00533 10/20 0.47
ABL1 P00519 2/20 0.47
ABL2 P42684 2/20 0.47
CSF1R P07333 2/20 0.47
TNKS O95271 1/20 0.47
ERBB2 P04626 1/20 0.47
FADS1 O60427 1/20 0.46
AURKA O14965 1/20 0.46
AURKB Q96GD4 1/20 0.46
INCENP Q9NQS7 1/20 0.46
TPX2 Q9ULW0 1/20 0.46
LCK P06239 1/20 0.46
CHUK O15111 1/20 0.46
INSR P06213 1/20 0.46
MAPK8 P45983 1/20 0.46
CAMKK2 Q96RR4 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
Hydrochloric Acid SCHEMBL4767230 0.99 BRAF (0.50) BRAFTNNI3KTTBK1TTBK2EGFR
SCHEMBL7498074 0.86 EGFR (0.57) BRAFTNNI3KTTBK1TTBK2EGFR
SCHEMBL4765640 0.86 EGFR (0.57) BRAFEGFRCSF1RERBB2AURKA
SCHEMBL4764733 0.85 EGFR (0.59) EGFRCSF1RTNKSERBB2AURKA
SCHEMBL4770048 0.85 EGFR (0.60) BRAFTNNI3KTTBK1TTBK2EGFR
SCHEMBL27442803 0.84 BRAF (0.62) BRAFTNNI3KTTBK1TTBK2EGFR
SCHEMBL2461054 0.84 BRAF (0.64) BRAFTNNI3KTTBK1TTBK2EGFR
SCHEMBL7493506 0.83 BRAF (0.52) BRAFTNNI3KTTBK1TTBK2EGFR
SCHEMBL7495114 0.83 TTBK1 (0.56) TTBK1TTBK2EGFRABL1ABL2
SCHEMBL7498606 0.83 BRAF (0.66) BRAFTNNI3KTTBK1TTBK2EGFR

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
CN-101560214-A 4-amino-6-phenyl-pyrrolo[2, 3-d]pyrimidine derivatives NOVARTIS AG (CH) 2009-10-21 CN claimed
EP-1416935-B1 4-AMINO-6-PHENYL-PYRROLO[2,3-D]PYRIMIDINE DERIVATIVES NOVARTIS AG (CH) 2008-03-12 EP claimed
CN-1538847-A 4-amino-6-phenyl-pyrrolo [2, 3-d ] pyrimidine derivatives ��˹��ŵ�� 2004-10-20 CN claimed
CN-101560214-B 4-amino-6-phenyl-pyrrolo[2, 3-d]pyrimidine derivatives NOVARTIS AG 2011-05-25 CN disclosed
CN-101560214-A 4-amino-6-phenyl-pyrrolo[2, 3-d]pyrimidine derivatives NOVARTIS AG (CH) 2009-10-21 CN disclosed
CN-1538847-A 4-amino-6-phenyl-pyrrolo [2, 3-d ] pyrimidine derivatives ��˹��ŵ�� 2004-10-20 CN disclosed