SCHEMBL11034685

SCHEMBL11034685

CC(Oc1ccccc1Oc1ncccc1I)C(=O)O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.54
GAA P10253 2/20 0.40
CYP1A2 P05177 1/20 0.40
CYP2C9 P11712 1/20 0.40
PKM P14618 1/20 0.40
CYP2C19 P33261 1/20 0.40
POLB P06746 1/20 0.38
MAPK8 P45983 1/20 0.38
TDP1 Q9NUW8 1/20 0.38
MAPK1 P28482 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
ALDH1A1 P00352 2/20 0.37
TSHR P16473 1/20 0.37
HTR2A P28223 1/20 0.37
HTR2C P28335 1/20 0.37
HTR2B P41595 1/20 0.37
SLC6A2 P23975 2/20 0.36
P2RY1 P47900 2/20 0.36
NOTUM Q6P988 1/20 0.36
PDE10A Q9Y233 1/20 0.36

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
SCHEMBL9173964 0.84 KMT2A (0.54) KMT2AGAACYP1A2CYP2C9PKM
SCHEMBL9482952 0.84 KMT2A (0.54) KMT2AGAACYP1A2CYP2C9PKM
SCHEMBL7934892 0.81 KMT2A (0.50) KMT2AALDH1A1SLC6A2P2RY1MAPT
SCHEMBL11993630 0.79 KMT2A (0.66) KMT2AGAACYP1A2CYP2C9PKM
SCHEMBL1967959 0.79 KMT2A (0.58) KMT2AGAACYP1A2CYP2C9PKM
SCHEMBL9362429 0.77 KMT2A (0.59) KMT2AGAACYP1A2CYP2C9PKM
SCHEMBL11007881 0.75 KMT2A (0.50) KMT2AGAACYP1A2CYP2C9PKM
SCHEMBL1538036 0.75 KMT2A (0.69) KMT2AGAACYP1A2CYP2C9PKM
SCHEMBL5513970 0.74 KMT2A (0.54) KMT2AGAACYP1A2CYP2C9PKM
SCHEMBL27094594 0.74 KMT2A (0.54) KMT2AGAACYP1A2CYP2C9PKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4517368-A 2,3-Dichloro-5-iodopyridine and methods of making and using the same THE DOW CHEMICAL COMPANY (US) 1985-05-14 US disclosed