SCHEMBL11389115

SCHEMBL11389115

Clc1ccc(CCCCCCBr)cc1Cl

nearest known ligand 0.59

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ IGF1R P08069 1/20 0.59
▸ ALOX15 P16050 1/20 0.59
▸ PNMT P11086 1/20 0.53
▸ TAAR1 Q96RJ0 1/20 0.53
▸ SIGMAR1 Q99720 13/20 0.49
▸ IDO1 P14902 2/20 0.47
▸ PYGL P06737 1/20 0.46
▸ CYP1A2 P05177 2/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ ALDH1A1 P00352 1/20 0.43
▸ TP53 P04637 1/20 0.43
▸ MAPT P10636 1/20 0.43
▸ CYP2C19 P33261 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ HDAC6 Q9UBN7 1/20 0.42
▸ CYP2D6 P10635 1/20 0.42
▸ TMEM97 Q5BJF2 1/20 0.42

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
SCHEMBL8211623 1.00 IGF1R (0.59) IGF1RALOX15PNMTTAAR1SIGMAR1
SCHEMBL7009306 1.00 IGF1R (0.59) IGF1RALOX15PNMTTAAR1SIGMAR1
SCHEMBL79213 0.92 IGF1R (0.58) IGF1RALOX15PNMTTAAR1SIGMAR1
SCHEMBL177296 0.83 PNMT (0.61) IGF1RALOX15PNMTTAAR1SIGMAR1
SCHEMBL30019331 0.83 PNMT (0.61) IGF1RALOX15PNMTTAAR1SIGMAR1
SCHEMBL11331998 0.80 PNMT (0.70) IGF1RALOX15PNMTTAAR1SIGMAR1
SCHEMBL11066232 0.80 SIGMAR1 (0.61) IGF1RALOX15PNMTTAAR1SIGMAR1
SCHEMBL8905774 0.80 IGF1R (0.59) IGF1RALOX15PNMTTAAR1SIGMAR1
SCHEMBL22333700 0.80 SIGMAR1 (0.61) IGF1RALOX15PNMTTAAR1SIGMAR1
SCHEMBL11332031 0.80 PNMT (0.70) IGF1RALOX15PNMTTAAR1SIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4275201-A Aryl substituted diketones STERLING DRUG INC. (US) 1981-06-23 — — US disclosed
US-4189500-A VIRICIDES STERLING DRUG INC. (US) 1980-02-19 — — US disclosed
US-4171378-A INSECTICIDES, VIRICIDES STERLING DRUG INC. (US) 1979-10-16 — — US disclosed
US-4125541-A Aryl substituted ketones STERLING DRUG INC. (US) 1978-11-14 — — US disclosed
US-4125714-A Aryl substituted cycloalkanones STERLING DRUG INC. (US) 1978-11-14 — — US disclosed
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