SCHEMBL11286352

SCHEMBL11286352

Cc1ccc(Cc2cnc(N)nc2N)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
DHFR P00374 2/20 0.68
PKM P14618 1/20 0.64

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
SCHEMBL1388263 0.85 CSF1R (0.52) DHFR
SCHEMBL8375784 0.83 DHFR (0.63) DHFR
SCHEMBL8380685 0.83 DHFR (0.63) DHFR
SCHEMBL3937299 0.83 DHFR (0.68) DHFR
SCHEMBL28876908 0.83 DHFR (0.63) DHFR
SCHEMBL380792 0.82 DHFR (0.67) DHFR
SCHEMBL23472333 0.82 PKM (0.49) DHFRPKM
SCHEMBL4468544 0.82 DHFR (0.62) DHFRPKM
SCHEMBL11601563 0.82 DHFR (0.62) DHFRPKM
SCHEMBL8380918 0.82 LMNA (0.66) DHFR

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-4315931-A MICROBIOCIDES, INFECTIOUS DISEASES BASF AKTIENGESELLSCHAFT (DE) 1982-02-16 US disclosed
US-4189581-A BACTERICIDES, POTENTIATORS OF SULFA DRUGS BASF AKTIENGESELLSCHAFT (DE) 1980-02-19 US disclosed