SCHEMBL17828138

SCHEMBL17828138

CCc1cncc(N2CCCC2=O)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP11B2 P19099 2/20 0.46
TP53 P04637 1/20 0.43
PKM P14618 1/20 0.43
MAPK1 P28482 1/20 0.43
NPC1 O15118 1/20 0.43
LMNA P02545 1/20 0.41
CCR6 P51684 1/20 0.41
USP2 O75604 1/20 0.40
ALDH1A1 P00352 2/20 0.40
PARP1 P09874 3/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C9 P11712 1/20 0.39
HPGD P15428 1/20 0.39
CYP2C19 P33261 1/20 0.39
ALOX5 P09917 1/20 0.39
PDE10A Q9Y233 1/20 0.39
TSHR P16473 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39

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
SCHEMBL17828142 0.91 CHRNB2 (0.38) CYP11B2TP53PKMMAPK1NPC1
SCHEMBL16095210 0.85 CYP11B2 (0.49) CYP11B2NPC1LMNACCR6USP2
SCHEMBL20153317 0.80 LMNA (0.48) CYP11B2TP53PKMMAPK1NPC1
SCHEMBL22573887 0.78 CYP11B2 (0.50) CYP11B2TP53PKMMAPK1NPC1
SCHEMBL30919616 0.78 CYP11B2 (0.50) CYP11B2TP53PKMMAPK1NPC1
SCHEMBL7902998 0.77 ALOX5 (0.59) NPC1ALDH1A1PARP1CYP1A2CYP3A4
SCHEMBL31745141 0.76 CYP11B2 (0.47) CYP11B2TP53PKMNPC1LMNA
SCHEMBL3377698 0.76 NPC1 (0.57) CYP11B2PKMNPC1LMNACCR6
SCHEMBL21317455 0.76 CCR6 (0.54) CYP11B2TP53PKMMAPK1NPC1
SCHEMBL21848976 0.76 CCR6 (0.51) CYP11B2TP53PKMMAPK1NPC1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230357254-A1 IMIDAZOPYRIDAZINES AS MODULATORS OF IL-17 JANSSEN PHARMACEUTICA NV (BE) 2023-11-09 US disclosed
US-9586951-B2 Morpholine derivative or salt thereof FUJIFILM CORPORATION (JP) 2017-03-07 US disclosed
US-9586951-B2 Morpholine derivative or salt thereof FUJIFILM CORPORATION (JP) 2017-03-07 US disclosed
EP-3042900-A1 NOVEL MORPHOLINE DERIVATIVE OR SALT THEREOF Fujifilm Corporation (JP) 2016-07-13 EP disclosed
US-20160168139-A1 NOVEL MORPHOLINE DERIVATIVE OR SALT THEREOF FUJIFILM CORPORATION (JP) 2016-06-16 US disclosed
US-20160168139-A1 NOVEL MORPHOLINE DERIVATIVE OR SALT THEREOF FUJIFILM CORPORATION (JP) 2016-06-16 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 (2 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-20230357254-A1 IMIDAZOPYRIDAZINES AS MODULATORS OF IL-17 IL17A, IL23R, IL15 CYP11B2 51/4885TP53 1513/4885PKM 3476/4885
US-20160168139-A1 NOVEL MORPHOLINE DERIVATIVE OR SALT THEREOF PRMT7, RBBP7, RER1 CYP11B2 1570/4885TP53 2054/4885PKM 4605/4885

“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.