SCHEMBL9566237

SCHEMBL9566237

Ic1ccc2cc(I)c(I)cc2c1

nearest known ligand 0.38

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
NOS1 P29475 1/20 0.38
MAPT P10636 1/20 0.33
CYP1A2 P05177 1/20 0.30
CYP2A6 P11509 1/20 0.30
ERN1 O75460 1/20 0.30

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
SCHEMBL19230462 0.88 NOS1 (0.41) NOS1MAPTCYP1A2CYP2A6ERN1
SCHEMBL9422180 0.88 NOS1 (0.41) NOS1MAPTCYP1A2CYP2A6ERN1
SCHEMBL29644321 0.87 NOS1 (0.44) NOS1MAPTCYP1A2CYP2A6ERN1
SCHEMBL1297632 0.87 NOS1 (0.44) NOS1MAPTCYP1A2CYP2A6ERN1
SCHEMBL30388219 0.84 NOS1 (0.42) NOS1MAPTCYP1A2CYP2A6ERN1
SCHEMBL6561374 0.84 NOS1 (0.42) NOS1MAPTCYP1A2CYP2A6ERN1
SCHEMBL10713877 0.84 NOS1 (0.42) NOS1MAPTCYP1A2CYP2A6ERN1
SCHEMBL8897121 0.80 ALDH1A1 (0.50) NOS1MAPTCYP1A2CYP2A6
SCHEMBL8268407 0.78 CYP2A6 (0.39) NOS1MAPTCYP1A2CYP2A6
SCHEMBL797261 0.77 TTR (0.33)

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
EP-0522469-A2 Preparation of poly(benz(ox, imid, thi)azole) polymers EASTMAN KODAK COMPANY (US) 1993-01-13 EP disclosed
US-5149755-A Aroatmic amine and halide reactants EASTMAN KODAK COMPANY (US) 1992-09-22 US disclosed
EP-0236348-B1 CARBONYLATION PROCESS FOR THE PRODUCTION OF AROMATIC ACIDS EASTMAN KODAK COMPANY (a New Jersey corporation) (US) 1990-05-02 EP disclosed
EP-0236348-A1 CARBONYLATION PROCESS FOR THE PRODUCTION OF AROMATIC ACIDS. EASTMAN KODAK CO (US) 1987-09-16 EP disclosed
US-4649216-A Carbonylation process for the production of aromatic acids EASTMAN KODAK COMPANY (US) 1987-03-10 US disclosed
WO-1987000829-A1 CARBONYLATION PROCESS FOR THE PRODUCTION OF AROMATIC ACIDS EASTMAN KODAK COMPANY (US) 1987-02-12 WO disclosed