SCHEMBL15701044

SCHEMBL15701044

CC(C)[C@@H](C(=O)Nc1ccc(NC(=O)c2cscn2)nc1)c1ccc(Cl)cc1

nearest known ligand 0.61

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
FFAR2 O15552 16/20 0.61
MEN1 O00255 2/20 0.59
KMT2A Q03164 2/20 0.59
HDAC3 O15379 2/20 0.52
HDAC1 Q13547 2/20 0.52
HDAC8 Q9BY41 2/20 0.52
HDAC4 P56524 1/20 0.52
HDAC6 Q9UBN7 1/20 0.52
LMNA P02545 1/20 0.48

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
SCHEMBL15701043 1.00 FFAR2 (0.61) FFAR2MEN1KMT2AHDAC3HDAC1
SCHEMBL19446696 1.00 FFAR2 (0.61) FFAR2MEN1KMT2AHDAC3HDAC1
SCHEMBL15701054 0.89 NPC1 (0.48) FFAR2MEN1KMT2AHDAC3HDAC1
SCHEMBL15701037 0.89 NPC1 (0.48) FFAR2MEN1KMT2AHDAC3HDAC1
SCHEMBL15701233 0.89 NPC1 (0.48) FFAR2MEN1KMT2AHDAC3HDAC1
SCHEMBL17148404 0.83 RAB9A (0.42) FFAR2MEN1KMT2ALMNA
SCHEMBL15701131 0.82 ALDH1A1 (0.43) FFAR2MEN1KMT2ALMNA
SCHEMBL15701128 0.81 FFAR2 (0.47) FFAR2MEN1KMT2AHDAC1LMNA
SCHEMBL17148297 0.79 S1PR3 (0.45) FFAR2MEN1KMT2ALMNA
SCHEMBL19446769 0.77 MAP3K5 (0.49) MEN1KMT2ALMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2914592-B1 INHIBITORS OF CYTOMEGALOVIRUS BOEHRINGER INGELHEIM INT (DE) 2017-10-11 EP disclosed
US-9334249-B2 Inhibitors of cytomegalovirus BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2016-05-10 US disclosed
US-20150284348-A1 INHIBITORS OF CYTOMEGALOVIRUS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2015-10-08 US disclosed
WO-2014070979-A1 INHIBITORS OF CYTOMEGALOVIRUS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2014-05-08 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-20150284348-A1 INHIBITORS OF CYTOMEGALOVIRUS CDKN1A, CCNA1, IFNAR1 FFAR2 4600/4885MEN1 534/4885KMT2A 617/4885

“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.