SCHEMBL974356

SCHEMBL974356

CCCN1CC(N)CCC1=O

nearest known ligand 0.37

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.33
L3MBTL1 Q9Y468 2/20 0.32
NPC1 O15118 4/20 0.31
RAB9A P51151 4/20 0.31
ADORA1 P30542 1/20 0.31
SRD5A1 P18405 1/20 0.31
KMT2A Q03164 1/20 0.30
CYP19A1 P11511 1/20 0.30
HTR1A P08908 1/20 0.30

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
SCHEMBL374144 1.00 POLB (0.33) POLBL3MBTL1NPC1RAB9AADORA1
SCHEMBL25021979 0.86 GBA1 (0.44) L3MBTL1CYP19A1
SCHEMBL14275822 0.85 TLR4 (0.31) NPC1RAB9A
SCHEMBL4760430 0.81 BRD4 (0.33) NPC1RAB9AKMT2A
SCHEMBL20721708 0.81 L3MBTL1 (0.36) POLBL3MBTL1KMT2ACYP19A1
SCHEMBL14275606 0.81 L3MBTL1 (0.36) POLBL3MBTL1KMT2ACYP19A1
SCHEMBL4760434 0.81 KMT2A (0.38) NPC1RAB9AKMT2A
Hydrochloric Acid SCHEMBL4339603 0.80 BRD4 (0.33) NPC1RAB9AKMT2A
SCHEMBL15088402 0.78 RAB9A (0.33) POLBL3MBTL1NPC1RAB9ASRD5A1
SCHEMBL21322343 0.76 PIK3CD (0.50) POLBNPC1RAB9A

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
US-8754073-B2 Substituted piperazino-dihydrothienopyrimidines BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2014-06-17 US disclosed
US-20110021501-A1 SUBSTITUTED PIPERAZINO-DIHYDROTHIENOPYRIMIDINES BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2011-01-27 US disclosed
US-7332509-B2 Heterocyclic amides, a process for their preparation, compositions comprising them and their use MERIAL LIMITED (US) 2008-02-19 US disclosed
US-7332509-B2 Heterocyclic amides, a process for their preparation, compositions comprising them and their use MERIAL LIMITED (US) 2008-02-19 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-20110021501-A1 SUBSTITUTED PIPERAZINO-DIHYDROTHIENOPYRIMIDINES DPYD, P2RX1, P2RX5 POLB 1624/4885L3MBTL1 3678/4885NPC1 3765/4885

“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.