SCHEMBL10291210

SCHEMBL10291210

COBNCCC(O)c1cccc(CCC2CCCCO2)c1

nearest known ligand 0.38

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ ROCK2 O75116 1/20 0.34
▸ SLC6A3 Q01959 2/20 0.33
▸ RAB9A P51151 2/20 0.33
▸ NPC1 O15118 1/20 0.33
▸ LMNA P02545 3/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ ALDH1A1 P00352 1/20 0.33
▸ POLB P06746 1/20 0.33
▸ MAPT P10636 1/20 0.33
▸ PKM P14618 1/20 0.33
▸ KMT2A Q03164 1/20 0.33
▸ NPSR1 Q6W5P4 1/20 0.33
▸ TDP1 Q9NUW8 1/20 0.33
▸ HPGD P15428 2/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL10235731 0.82 PDE4A (0.38) LMNAMEN1KMT2AHPGD
SCHEMBL612243 0.82 LMNA (0.36) SLC6A3LMNA
SCHEMBL10258837 0.82 RAB9A (0.34) RAB9ANPC1LMNAMEN1PKM
SCHEMBL612678 0.80 NPC1 (0.37) ROCK2RAB9ANPC1LMNAALDH1A1
SCHEMBL15662169 0.72 LMNA (0.36) RAB9ALMNAMEN1PKMKMT2A
SCHEMBL11996501 0.70 HIF1A (0.51) SLC6A3RAB9ALMNAMEN1KMT2A
SCHEMBL12817600 0.69 HPGD (0.46) RAB9ANPC1LMNAMEN1ALDH1A1
SCHEMBL25825926 0.69 SMN1; SMN2 (0.44) RAB9ANPC1LMNAALDH1A1MAPT
SCHEMBL19291621 0.66 MTNR1A (0.45) NPC1MEN1KMT2A
SCHEMBL10235806 0.66 BCHE (0.39) —

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-20120041038-A1 AMINE DERIVATIVE COMPOUNDS FOR TREATING OPHTHALMIC DISEASES AND DISORDERS ACUCELA INC. (US) 2012-02-16 — — US disclosed
WO-2009058216-A1 AMINE DERIVATIVE COMPOUNDS FOR TREATING OPHTHALMIC DISEASES AND DISORDERS ACUCELA, INC. (US) 2009-05-07 — — WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20120041038-A1 AMINE DERIVATIVE COMPOUNDS FOR TREATING OPHTHALMIC DISEASES AND DISORDERS PDE6D, CLN6, AADAT ROCK2 885/4885SLC6A3 277/4885RAB9A 1274/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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