SCHEMBL4018098

SCHEMBL4018098

NC1CCN(c2ccnc3ccccc23)CC1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NCF1 P14598 2/20 0.63
ADRB2 P07550 1/20 0.63
AKT2 P31751 1/20 0.57
KCNH2 Q12809 2/20 0.51
SSTR2 P30874 3/20 0.49
F10 P00742 2/20 0.45
HRH3 Q9Y5N1 1/20 0.45
CNR2 P34972 1/20 0.45
AKT1 P31749 1/20 0.45
PDGFRB P09619 1/20 0.44
PKM P14618 1/20 0.43
ALOX15 P16050 1/20 0.43
CASP1 P29466 1/20 0.43
HSD17B10 Q99714 1/20 0.43
DRD2 P14416 1/20 0.43
DRD3 P35462 1/20 0.43
ROCK2 O75116 1/20 0.42
ROCK1 Q13464 1/20 0.42
CDC42BPB Q9Y5S2 1/20 0.42
CHKA P35790 1/20 0.42

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
SCHEMBL5137952 0.91 NCF1 (0.56) NCF1ADRB2AKT2KCNH2SSTR2
SCHEMBL28251236 0.84 NCF1 (0.63) NCF1ADRB2AKT2KCNH2F10
SCHEMBL22755427 0.84 ADRB2 (0.63) NCF1ADRB2KCNH2CNR2PDGFRB
SCHEMBL29722401 0.84 ADRB2 (0.58) NCF1ADRB2AKT2KCNH2F10
SCHEMBL18980471 0.84 ADRB2 (0.58) NCF1ADRB2AKT2KCNH2F10
SCHEMBL30404498 0.82 PBK (0.61) NCF1ADRB2KCNH2ROCK2ROCK1
Hydrochloric Acid SCHEMBL18979970 0.82 ADRB2 (0.57) NCF1ADRB2AKT2KCNH2F10
Hydrochloric Acid SCHEMBL18980776 0.82 ADRB2 (0.57) NCF1ADRB2AKT2KCNH2F10
Hydrochloric Acid SCHEMBL29722226 0.82 ADRB2 (0.57) NCF1ADRB2AKT2KCNH2F10
SCHEMBL14515644 0.82 NCF1 (0.73) NCF1ADRB2KCNH2AKT1PDGFRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2021076448-A1 SOMATOSTATIN MODULATORS FOR TREATING PITUITARY ADENOMAS Crinetics Pharmaceuticals, Inc. (US) 2021-04-22 WO claimed
EP-2066654-A1 N-(1-HETARYLPIPERIDIN-4-YL)(HET)ARYLAMIDES AS EP2 RECEPTOR MODULATORS Bayer Schering Pharma AG (DE) 2009-06-10 EP claimed
US-20080125463-A1 N-(1-hetarylpiperidin-4-yl)(het)arylamides as EP2 receptor modulators BAYER SCHERING PHARMA AG (DE) 2008-05-29 US claimed
EP-1903038-A1 N-(1-hetaryl-piperidin-4-yl)-(het)arylamide as EP2 receptor modulators Bayer Schering Pharma Aktiengesellschaft (DE) 2008-03-26 EP claimed
WO-2008028691-A1 N-(1-HETARYLPIPERIDIN-4-YL)(HET)ARYLAMIDES AS EP2 RECEPTOR MODULATORS BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2008-03-13 WO claimed
US-20210087165-A1 PROCESS OF MAKING SOMATOSTATIN MODULATORS Crinetics Pharmaceuticals, Inc. 2021-03-25 US disclosed
WO-2021011641-A1 CRYSTALLINE FORMS OF SOMATOSTATIN MODULATORS Crinetics Pharmaceuticals, Inc. (US) 2021-01-21 WO disclosed
US-10889561-B2 Process of making somatostatin modulators Crinetics Pharmaceuticals, Inc. (US) 2021-01-12 US disclosed
US-20200048219-A1 PROCESS OF MAKING SOMATOSTATIN MODULATORS Crinetics Pharmaceuticals, Inc. 2020-02-13 US disclosed
US-10464918-B2 Process of making somatostatin modulators Crinetics Pharmaceuticals, Inc. (US) 2019-11-05 US disclosed
US-20190218202-A1 PROCESS OF MAKING SOMATOSTATIN MODULATORS Crinetics Pharmaceuticals, Inc. 2019-07-18 US disclosed
EP-2066654-A1 N-(1-HETARYLPIPERIDIN-4-YL)(HET)ARYLAMIDES AS EP2 RECEPTOR MODULATORS Bayer Schering Pharma AG (DE) 2009-06-10 EP disclosed
US-20080125463-A1 N-(1-hetarylpiperidin-4-yl)(het)arylamides as EP2 receptor modulators BAYER SCHERING PHARMA AG (DE) 2008-05-29 US disclosed
EP-1903038-A1 N-(1-hetaryl-piperidin-4-yl)-(het)arylamide as EP2 receptor modulators Bayer Schering Pharma Aktiengesellschaft (DE) 2008-03-26 EP disclosed
WO-2008028691-A1 N-(1-HETARYLPIPERIDIN-4-YL)(HET)ARYLAMIDES AS EP2 RECEPTOR MODULATORS BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2008-03-13 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 (6 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-10464918-B2 Process of making somatostatin modulators SSTR5, SSTR4, SSTR2 NCF1 3102/4885ADRB2 224/4885AKT2 1922/4885
US-20190218202-A1 PROCESS OF MAKING SOMATOSTATIN MODULATORS SSTR5, SSTR4, SSTR2 NCF1 3102/4885ADRB2 224/4885AKT2 1922/4885
US-20210087165-A1 PROCESS OF MAKING SOMATOSTATIN MODULATORS SSTR5, SSTR4, SSTR2 NCF1 3102/4885ADRB2 224/4885AKT2 1922/4885
US-20200048219-A1 PROCESS OF MAKING SOMATOSTATIN MODULATORS SSTR5, SSTR4, SSTR2 NCF1 3102/4885ADRB2 224/4885AKT2 1922/4885
US-20080125463-A1 N-(1-hetarylpiperidin-4-yl)(het)arylamides as EP2 receptor modulators PTGER2, PTGER1, PTGDR2 NCF1 2439/4885ADRB2 71/4885AKT2 2349/4885
US-10889561-B2 Process of making somatostatin modulators SSTR5, SSTR4, SSTR2 NCF1 3102/4885ADRB2 224/4885AKT2 1922/4885

“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.