Iodomethane

Iodomethane

SCHEMBL11477652

CI.COc1ccccc1C(=O)OCc1ccccn1

nearest known ligand 0.60

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 6/20 0.54
NPC1 O15118 5/20 0.54
L3MBTL1 Q9Y468 2/20 0.51
SMN1; SMN2 Q16637 3/20 0.50
TP53 P04637 2/20 0.50
KMT2A Q03164 2/20 0.50
MEN1 O00255 1/20 0.50
GAA P10253 1/20 0.50
MAPT P10636 2/20 0.48
HPGD P15428 2/20 0.48
CASP3 P42574 2/20 0.48
SENP8 Q96LD8 2/20 0.48
SENP7 Q9BQF6 2/20 0.48
SENP6 Q9GZR1 2/20 0.48
CYP1A2 P05177 1/20 0.48
CYP3A4 P08684 1/20 0.48
CYP2D6 P10635 1/20 0.48
CYP2C9 P11712 1/20 0.48
CYP2C19 P33261 1/20 0.48
SYK P43405 2/20 0.48

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
Iodomethane SCHEMBL11482698 0.83 CASP3 (0.54) RAB9ANPC1L3MBTL1SMN1; SMN2TP53
SCHEMBL10697623 0.82 SMN1; SMN2 (0.57) RAB9ANPC1L3MBTL1SMN1; SMN2KMT2A
Iodomethane SCHEMBL11489847 0.80 KMT2A (0.59) RAB9ANPC1SMN1; SMN2KMT2AMEN1
SCHEMBL11475412 0.78 CASP3 (0.58) RAB9ANPC1L3MBTL1SMN1; SMN2KMT2A
Iodomethane SCHEMBL11478139 0.78 RAB9A (0.57) RAB9ANPC1L3MBTL1SMN1; SMN2KMT2A
Iodomethane SCHEMBL11482553 0.76 NPC1 (0.56) RAB9ANPC1SMN1; SMN2KMT2AMEN1
SCHEMBL8432905 0.76 ALDH1A1 (0.65) RAB9ANPC1L3MBTL1TP53KMT2A
Hydrochloric Acid SCHEMBL11475020 0.76 POLB (0.59) RAB9ANPC1L3MBTL1SMN1; SMN2TP53
SCHEMBL3696044 0.76 RAB9A (0.61) RAB9ANPC1SMN1; SMN2TP53KMT2A
SCHEMBL20918141 0.74 NPSR1 (0.58) RAB9ANPC1L3MBTL1SMN1; SMN2KMT2A

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-4184040-A ANTIARRHYTHMIA AGENTS RICHTER GEDEON VEGYESZETI GYAR RT. (HU) 1980-01-15 US disclosed