SCHEMBL6670748

SCHEMBL6670748

O=C(O)N1CCC2Oc3c(SC4CCCC4)cc(-c4ccc(Cl)cc4Cl)cc3C2C1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 1/20 0.38
NPC1 O15118 4/20 0.34
RAB9A P51151 4/20 0.34
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
CASP3 P42574 1/20 0.33
SENP8 Q96LD8 1/20 0.33
SENP7 Q9BQF6 1/20 0.33
SENP6 Q9GZR1 1/20 0.33
CNR1 P21554 6/20 0.32
CNR2 P34972 1/20 0.32
HPGD P15428 2/20 0.31
SMN1; SMN2 Q16637 2/20 0.31
ALDH1A1 P00352 1/20 0.31
LMNA P02545 1/20 0.31
MAPK1 P28482 1/20 0.31
TP53 P04637 1/20 0.31
DPP4 P27487 2/20 0.31
PROKR1 Q8TCW9 1/20 0.31
USP30 Q70CQ3 1/20 0.31

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
SCHEMBL6694684 0.98 MGLL (0.38) MGLLNPC1RAB9AMEN1KMT2A
SCHEMBL6672317 0.89 MGLL (0.39) MGLLNPC1RAB9AMEN1KMT2A
SCHEMBL6671678 0.86 MGLL (0.37) MGLLNPC1RAB9AMEN1KMT2A
SCHEMBL6672829 0.84 DPP4 (0.36) MGLLNPC1RAB9AMEN1KMT2A
SCHEMBL6669036 0.84 MGLL (0.36) MGLLNPC1RAB9AMEN1KMT2A
SCHEMBL6670063 0.83 MGLL (0.40) MGLLNPC1RAB9AMEN1KMT2A
SCHEMBL6670911 0.79 MARS1 (0.38) MGLLMEN1KMT2ACNR1HPGD
SCHEMBL6669412 0.78 MGLL (0.43) MGLLNPC1RAB9AMEN1KMT2A
SCHEMBL6798682 0.78 HTR2C (0.34) KMT2AMAPK1
SCHEMBL6668619 0.77 HTR2C (0.33) KMT2AMAPK1

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
US-20040214815-A1 Therapeutic compounds PHARMACIA & UPJOHN COMPANY 2004-10-28 US disclosed
US-6762191-B2 TREATING DISEASES FOR MODULATING OF 5-HT ACTIVITY, CENTRAL NERVOUS SYSTEM DISORDERS, ANXIETY, OBESITY, DEPRESSION, OR A STRESS-RELATED DISEASE PHARMACIA & UPJOHN COMPANY 2004-07-13 US disclosed
EP-1404679-A2 (HETERO)ARYL SUBSTITUTED BENZOFURANS AS 5-HT LIGANDS PHARMACIA & UPJOHN COMPANY (US) 2004-04-07 EP disclosed
US-20030050304-A1 Therapeutic compounds PHARMACIA & UPJOHN COMPANY 2003-03-13 US disclosed
WO-2003004501-A2 (HETERO) ARYL SUBSTITUTED BENZOFURANS AS 5-HT LIGANDS PHARMACIA & UPJOHN COMPANY (US) 2003-01-16 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 (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-20040214815-A1 Therapeutic compounds HTR5A, HTR6, HTR1A MGLL 3067/4885NPC1 673/4885RAB9A 1464/4885
US-20030050304-A1 Therapeutic compounds HTR5A, HTR6, HTR1A MGLL 3067/4885NPC1 673/4885RAB9A 1464/4885

“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.