SCHEMBL4865076

SCHEMBL4865076

NC(=O)N1CCCCc2ccccc21

nearest known ligand 0.67

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 3/20 0.67
AVPR2 P30518 8/20 0.64
AVPR1A P37288 6/20 0.64
NOTUM Q6P988 1/20 0.63
OXTR P30559 2/20 0.60
ALDH1A1 P00352 2/20 0.58
POLB P06746 2/20 0.58
KDM4E B2RXH2 1/20 0.58
PKM P14618 1/20 0.58
SIGMAR1 Q99720 1/20 0.57
HTT P42858 2/20 0.56
MAPT P10636 1/20 0.56
HPGD P15428 1/20 0.56
MEN1 O00255 2/20 0.55
KMT2A Q03164 2/20 0.55
NPSR1 Q6W5P4 1/20 0.55
TSHR P16473 1/20 0.55

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
SCHEMBL3120560 0.95 SMN1; SMN2 (0.74) SMN1; SMN2NOTUMALDH1A1POLBKDM4E
SCHEMBL29640094 0.95 SMN1; SMN2 (0.74) SMN1; SMN2NOTUMALDH1A1POLBKDM4E
SCHEMBL29443491 0.87 NOTUM (0.68) SMN1; SMN2NOTUMALDH1A1POLBPKM
SCHEMBL43169 0.87 NOTUM (0.68) SMN1; SMN2NOTUMALDH1A1POLBPKM
SCHEMBL30829142 0.86 NOTUM (0.63) SMN1; SMN2NOTUMALDH1A1POLBKDM4E
SCHEMBL30829143 0.86 NOTUM (0.63) SMN1; SMN2NOTUMALDH1A1POLBKDM4E
Hydrochloric Acid SCHEMBL29858239 0.86 NOTUM (0.66) SMN1; SMN2NOTUMALDH1A1POLBPKM
Hydrochloric Acid SCHEMBL5573069 0.86 NOTUM (0.66) SMN1; SMN2NOTUMALDH1A1POLBPKM
SCHEMBL30456228 0.84 SMN1; SMN2 (0.69) SMN1; SMN2AVPR2AVPR1ANOTUMOXTR
SCHEMBL5423105 0.83 NOTUM (0.90) SMN1; SMN2AVPR2AVPR1ANOTUMOXTR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3596061-B1 COMPOUNDS USEFUL IN THE TREATMENT OR PREVENTION OF A PRMT5-MEDIATED DISORDER ARGONAUT THERAPEUTICS LTD (GB) 2023-09-06 EP disclosed
US-7368444-B2 N-carbamoyl nitrogen-containing fused ring compounds and drugs containing these compounds as the active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 2008-05-06 US disclosed
US-20050101600-A1 N-carbamoyl nitrogen-containing fused ring compounds and drugs containing these compounds as the active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 2005-05-12 US disclosed
EP-1475368-A1 N-CARBAMOYL NITROGEN-CONTAINING FUSED RING COMPOUNDS AND DRUGS CONTAINING THESE COMPOUNDS AS THE ACTIVE INGREDIENT ONO PHARMACEUTICAL CO., LTD. (JP) 2004-11-10 EP disclosed
US-20010025045-A1 Substituted isoquinoline derivatives and their use as anticonvulsants SMITHKLINE BEECHAM P.L.C. 2001-09-27 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-20010025045-A1 Substituted isoquinoline derivatives and their use as anticonvulsants INA, GRIN2C, GRIN2A SMN1; SMN2 1323/4885AVPR2 600/4885AVPR1A 611/4885
US-20050101600-A1 N-carbamoyl nitrogen-containing fused ring compounds and drugs containing these compounds as the active ingredient CNR1, CNR2, NPSR1 SMN1; SMN2 2595/4885AVPR2 124/4885AVPR1A 276/4885

“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.