SCHEMBL3313800

SCHEMBL3313800

O=C(O)c1ccc(NC(=O)c2ccc(Cl)nc2)cc1

nearest known ligand 0.75

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 3/20 0.75
▸ SMN1; SMN2 Q16637 2/20 0.75
▸ ALDH1A1 P00352 2/20 0.66
▸ MEN1 O00255 2/20 0.66
▸ KMT2A Q03164 2/20 0.66
▸ LMNA P02545 1/20 0.66
▸ NAPRT Q6XQN6 1/20 0.66
▸ KCNQ3 O43525 7/20 0.65
▸ KCNQ2 O43526 7/20 0.65
▸ KCNE1 P15382 5/20 0.65
▸ KCNQ1 P51787 5/20 0.65
▸ P4HTM Q9NXG6 1/20 0.64
▸ BACE1 P56817 1/20 0.63
▸ MAPT P10636 4/20 0.61
▸ KDM4E B2RXH2 1/20 0.59
▸ NPC1 O15118 1/20 0.59
▸ L3MBTL1 Q9Y468 1/20 0.59

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
SCHEMBL1986996 0.89 KCNQ3 (0.82) RAB9ASMN1; SMN2ALDH1A1MEN1KMT2A
SCHEMBL2306301 0.89 RAB9A (0.76) RAB9ASMN1; SMN2ALDH1A1MEN1KMT2A
SCHEMBL5215207 0.88 KCNQ3 (0.81) RAB9ASMN1; SMN2ALDH1A1MEN1KMT2A
SCHEMBL8361559 0.86 RAB9A (1.00) RAB9ASMN1; SMN2ALDH1A1MEN1KMT2A
SCHEMBL2801974 0.86 KCNQ3 (0.85) RAB9ASMN1; SMN2ALDH1A1MEN1KMT2A
SCHEMBL1844238 0.83 RAB9A (0.74) RAB9ASMN1; SMN2ALDH1A1MEN1KMT2A
SCHEMBL2302748 0.83 RAB9A (0.74) RAB9ASMN1; SMN2ALDH1A1MEN1KMT2A
SCHEMBL14516647 0.82 RAB9A (0.72) RAB9ASMN1; SMN2ALDH1A1MEN1KMT2A
SCHEMBL2302302 0.82 RAB9A (0.72) RAB9ASMN1; SMN2ALDH1A1MEN1KMT2A
SCHEMBL4177141 0.82 RAB9A (0.68) RAB9ASMN1; SMN2ALDH1A1MEN1KMT2A

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-8324385-B2 Diacylglycerol acyltransferase inhibitors MADRIGAL PHARMACEUTICALS, INC. (US) 2012-12-04 — — US disclosed
US-20100113782-A1 Diacylglycerol Acyltransferase Inhibitors MADRIGAL PHARMACEUTICALS, INC. 2010-05-06 — — US 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-20100113782-A1 Diacylglycerol Acyltransferase Inhibitors DGAT2, DGAT1, MOGAT2 RAB9A 2586/4885SMN1; SMN2 4749/4885ALDH1A1 802/4885

“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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