SCHEMBL2300445

SCHEMBL2300445

Cc1cc(NC(=O)c2ccc(Cl)nc2)ccc1I

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 3/20 0.67
▸ SMN1; SMN2 Q16637 2/20 0.67
▸ KCNQ3 O43525 9/20 0.62
▸ KCNQ2 O43526 9/20 0.62
▸ KMT2A Q03164 6/20 0.60
▸ MEN1 O00255 5/20 0.60
▸ LMNA P02545 2/20 0.60
▸ ALDH1A1 P00352 1/20 0.60
▸ KCNE1 P15382 7/20 0.58
▸ KCNQ1 P51787 7/20 0.58
▸ MAPT P10636 4/20 0.58
▸ CYP1A2 P05177 1/20 0.57
▸ CYP2D6 P10635 1/20 0.57
▸ CYP2C9 P11712 1/20 0.57
▸ CYP2C19 P33261 1/20 0.57
▸ TDP1 Q9NUW8 1/20 0.53
▸ BACE1 P56817 1/20 0.53
▸ NPC1 O15118 1/20 0.52
▸ POLB P06746 1/20 0.52
▸ L3MBTL1 Q9Y468 1/20 0.51

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
SCHEMBL2306227 0.90 RAB9A (0.67) RAB9ASMN1; SMN2KCNQ3KCNQ2KMT2A
SCHEMBL2303285 0.88 KCNQ3 (0.80) RAB9ASMN1; SMN2KCNQ3KCNQ2KMT2A
SCHEMBL2300783 0.86 MAPT (0.63) RAB9ASMN1; SMN2KCNQ3KCNQ2KMT2A
SCHEMBL2302662 0.84 KCNQ3 (0.64) RAB9ASMN1; SMN2KCNQ3KCNQ2KMT2A
SCHEMBL8361559 0.80 RAB9A (1.00) RAB9ASMN1; SMN2KCNQ3KCNQ2KMT2A
SCHEMBL5215207 0.80 KCNQ3 (0.81) RAB9ASMN1; SMN2KCNQ3KCNQ2KMT2A
SCHEMBL3134896 0.79 KCNQ3 (0.78) RAB9ASMN1; SMN2KCNQ3KCNQ2KMT2A
SCHEMBL404209 0.79 SMN1; SMN2 (0.74) RAB9ASMN1; SMN2KCNQ3KCNQ2KMT2A
SCHEMBL259296 0.78 KMT2A (0.80) RAB9ASMN1; SMN2KCNQ3KCNQ2KMT2A
SCHEMBL3312207 0.77 KCNQ3 (0.63) RAB9ASMN1; SMN2KCNQ3KCNQ2KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2350311-B1 DIACYLGLYCEROL ACYLTRANSFERASE INHIBITORS MADRIGAL PHARMACEUTICALS INC (US) 2013-12-25 — — EP disclosed
US-8324385-B2 Diacylglycerol acyltransferase inhibitors MADRIGAL PHARMACEUTICALS, INC. (US) 2012-12-04 — — US disclosed
US-8324385-B2 Diacylglycerol acyltransferase inhibitors MADRIGAL PHARMACEUTICALS, INC. (US) 2012-12-04 — — US disclosed
US-8324385-B2 Diacylglycerol acyltransferase inhibitors MADRIGAL PHARMACEUTICALS, INC. (US) 2012-12-04 — — US disclosed
CN-102203280-A Diacylglycerol acyltransferase inhibitors VIA PHARMACEUTICALS INC 2011-09-28 — — CN disclosed
EP-2350311-A1 DIACYLGLYCEROL ACYLTRANSFERASE INHIBITORS Via Pharmaceuticals, Inc. (US) 2011-08-03 — — EP disclosed
WO-2010056506-A1 DIACYLGLYCEROL ACLYTRANSFERASE INHIBITORS VIA PHARMACEUTICALS, INC. (US) 2010-05-20 — — WO disclosed
WO-2010056506-A1 DIACYLGLYCEROL ACLYTRANSFERASE INHIBITORS VIA PHARMACEUTICALS, INC. (US) 2010-05-20 — — WO disclosed
US-20100113782-A1 Diacylglycerol Acyltransferase Inhibitors MADRIGAL PHARMACEUTICALS, INC. 2010-05-06 — — US disclosed
US-20100113782-A1 Diacylglycerol Acyltransferase Inhibitors MADRIGAL PHARMACEUTICALS, INC. 2010-05-06 — — 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 4749/4885KCNQ3 410/4885

“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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