SCHEMBL4037576

SCHEMBL4037576

CCCc1cc(Nc2nc(NCc3cc(-c4ccccn4)no3)ncc2Br)n[nH]1

nearest known ligand 0.87

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 19/20 0.87
FGFR1 P11362 11/20 0.87
KDR P35968 11/20 0.87
INSR P06213 5/20 0.72
NTRK1 P04629 1/20 0.51
CDK2 P24941 1/20 0.51
NTRK2 Q16620 1/20 0.51

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
SCHEMBL4036446 0.93 IGF1R (1.00) IGF1RFGFR1KDRINSRNTRK1
SCHEMBL2121062 0.90 IGF1R (0.84) IGF1RFGFR1KDRINSRNTRK1
SCHEMBL3870821 0.87 IGF1R (0.82) IGF1RFGFR1KDRINSRNTRK1
SCHEMBL4033971 0.86 IGF1R (0.82) IGF1RFGFR1KDRINSRNTRK1
SCHEMBL3865429 0.84 IGF1R (1.00) IGF1RFGFR1KDRINSRNTRK1
SCHEMBL4034969 0.83 IGF1R (0.85) IGF1RFGFR1KDRINSRNTRK1
SCHEMBL4208194 0.80 IGF1R (1.00) IGF1RFGFR1KDRINSR
SCHEMBL2122642 0.79 IGF1R (0.72) IGF1RFGFR1KDRINSR
SCHEMBL4035278 0.78 IGF1R (0.83) IGF1RFGFR1KDRINSRNTRK1
SCHEMBL3864859 0.78 IGF1R (0.79) IGF1RFGFR1KDRINSRNTRK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230035892-A1 METHODS AND COMPOSITIONS FOR TREATING CANCER FLAGSHIP PIONEERING, INC. 2023-02-02 US disclosed
EP-1456182-B1 PYRIMIDINE DERIVATIVES AS MODULATORS OF INSULINE-LIKE GROWTH FACTOR-1 RECEPTOR (IGF-I) ASTRAZENECA AB (SE) 2009-03-11 EP disclosed