SCHEMBL4044055

SCHEMBL4044055

CO[C@@H]1CCN(OC(=O)C(F)(F)F)C1

nearest known ligand 0.30

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 1/20 0.30
RAB9A P51151 1/20 0.30
KMT2A Q03164 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
SCHEMBL5772842 1.00 NPC1 (0.30) NPC1RAB9AKMT2A
SCHEMBL27852284 0.92 DPP4 (0.32)
SCHEMBL27852285 0.92 DPP4 (0.32)
SCHEMBL2912964 0.89 KCNQ3 (0.32) NPC1RAB9AKMT2A
SCHEMBL932731 0.87 PDK2 (0.32)
SCHEMBL27780498 0.84 KCNQ3 (0.32) NPC1RAB9AKMT2A
SCHEMBL27801964 0.84 KCNQ3 (0.32) NPC1RAB9AKMT2A
SCHEMBL3338492 0.82 ACACB (0.32)
SCHEMBL5422443 0.79 DPP4 (0.38) NPC1KMT2A
SCHEMBL20577163 0.79 MGLL (0.33) RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250313560-A1 Novel bicyclic benzylamido pyridine derivatives as SOS1 inhibitors BOEHRINGER INGELHEIM INT (DE) 2025-10-09 US disclosed
US-10435403-B2 Positive allosteric modulators of muscarinic M2 receptor BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2019-10-08 US disclosed
US-20180297994-A1 POSITIVE ALLOSTERIC MODULATORS OF MUSCARINIC M2 RECEPTOR BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2018-10-18 US disclosed
EP-3307741-A1 POSITIVE ALLOSTERIC MODULATORS OF MUSCARINIC M2 RECEPTOR Bayer Pharma Aktiengesellschaft (DE) 2018-04-18 EP disclosed
EP-1620437-B1 5,7-DIAMINOPYRAZOLO¬4,3-D PYRIMIDINES USEFUL IN THE TRAETMENT OF HYPERTENSION PFIZER LTD (GB) 2009-06-17 EP disclosed
US-20070270412-A1 NOVEL PHARMACEUTICALS PFIZER INC 2007-11-22 US disclosed
US-7262192-B2 Substituted pyrazolo[4,3-d]pyrimidines and their use as PDE-5 inhibitors PFIZER INC. (US) 2007-08-28 US disclosed
US-7060836-B2 Lactams as tachykinin antagonists PFIZER, INC (US) 2006-06-13 US disclosed
CN-1780841-A 5,7-diaminopyrazolo[4,3-d]pyrimidines useful in the traetment of hypertension PFIZER LTD (GB) 2006-05-31 CN disclosed
US-20050043325-A1 Novel pharmaceuticals PFIZER INC 2005-02-24 US disclosed
EP-1456200-A1 LACTAMS AS TACHYKININ ANTAGONISTS Pfizer Limited (GB) 2004-09-15 EP disclosed
US-20040132710-A1 Lactams as tachkinin antagonists PFIZER INC. 2004-07-08 US disclosed
WO-2003051868-A1 LACTAMS AS TACHYKININ ANTAGONISTS PFIZER LIMITED (GB) 2003-06-26 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-20180297994-A1 POSITIVE ALLOSTERIC MODULATORS OF MUSCARINIC M2 RECEPTOR CHRM2, CHRM1, CHRM3 NPC1 4095/4885RAB9A 2148/4885KMT2A 1318/4885
US-20050043325-A1 Novel pharmaceuticals ABCB11, PCSK9, SLC10A1 NPC1 23/4885RAB9A 729/4885KMT2A 4632/4885
US-20040132710-A1 Lactams as tachkinin antagonists PROKR1, TACR2, TACR1 NPC1 662/4885RAB9A 1515/4885KMT2A 1970/4885
US-10435403-B2 Positive allosteric modulators of muscarinic M2 receptor CHRM2, CHRM1, CHRM3 NPC1 4095/4885RAB9A 2148/4885KMT2A 1318/4885
US-20250313560-A1 Novel bicyclic benzylamido pyridine derivatives as SOS1 inhibitors SOS1, SOS2, RSU1 NPC1 1720/4885RAB9A 666/4885KMT2A 3185/4885
US-20070270412-A1 NOVEL PHARMACEUTICALS ABCB11, PCSK9, SLC10A1 NPC1 23/4885RAB9A 729/4885KMT2A 4632/4885

“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.