SCHEMBL7522898

SCHEMBL7522898

CN1CCN(N=Cc2ccc(C3=NOC(CN4CCN(CC(=O)O)CC4)C3)cc2)CC1

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 6/20 0.45
RAB9A P51151 6/20 0.45
NPC1 O15118 5/20 0.45
MAPK1 P28482 4/20 0.45
MAPT P10636 4/20 0.45
MIF P14174 8/20 0.40
HDAC6 Q9UBN7 1/20 0.38
LMNA P02545 3/20 0.38
GAA P10253 2/20 0.38
THRB P10828 1/20 0.38
KMT2A Q03164 3/20 0.38
ALDH1A1 P00352 3/20 0.38
MEN1 O00255 1/20 0.38
GFER P55789 1/20 0.38
PKM P14618 1/20 0.37

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
SCHEMBL7527858 0.90 MIF (0.41) SMN1; SMN2RAB9ANPC1MAPK1MAPT
SCHEMBL7526512 0.90 MIF (0.41) SMN1; SMN2RAB9ANPC1MAPK1MAPT
SCHEMBL7523927 0.90 MIF (0.41) SMN1; SMN2RAB9ANPC1MAPK1MAPT
SCHEMBL7534041 0.88 RAB9A (0.43) SMN1; SMN2RAB9ANPC1MAPK1MAPT
SCHEMBL7528999 0.88 RAB9A (0.48) SMN1; SMN2RAB9ANPC1MAPK1MAPT
SCHEMBL7381769 0.88 MIF (0.43) SMN1; SMN2RAB9ANPC1MAPK1MAPT
SCHEMBL7532695 0.88 NPC1 (0.41) SMN1; SMN2RAB9ANPC1MAPK1MAPT
SCHEMBL7534752 0.87 MIF (0.39) SMN1; SMN2RAB9ANPC1MAPK1MAPT
SCHEMBL7530435 0.87 MIF (0.39) RAB9ANPC1MIFHDAC6
SCHEMBL7532605 0.87 RAB9A (0.41) SMN1; SMN2RAB9ANPC1MAPK1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6476226-B2 PLATELET GLYCOPROTEIN IIB/IIIA FIBRINOGEN; ANTICOAGULANTS; THROMBOLYTIC AGENTS; THROMBOEMBOLIC DISORDERS; ANTIINFLAMMATORY AGENTS; BONE DISORDERS; ANTITUMOR, -METASTASIS, -ARTHRITIC AGENTS; ASTHMA; PSORIASIS BRISTOL-MYERS SQUIBB PHARMA COMPANY 2002-11-05 US disclosed
US-20020094978-A1 Novel isoxazoline fibrinogen receptor antagonists BRISTOL-MYERS SQUIBB PHARMA COMPANY 2002-07-18 US disclosed
US-6303609-B1 USED FOR THE INHIBITION OF PLATELET AGGREGATION, AS THROMBOLYTICS, AND/OR FOR THE TREATMENT OF THROMBOEMBOLIC DISORDERS DUPONT PHARMACEUTICALS COMPANY 2001-10-16 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 (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-20020094978-A1 Novel isoxazoline fibrinogen receptor antagonists F13B, F11, FGB SMN1; SMN2 4508/4885RAB9A 3224/4885NPC1 3438/4885

“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.