SCHEMBL6023528

SCHEMBL6023528

c1ccc2c(c1)Cc1ccccc1N2c1ccc(-c2nc3ccccc3s2)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 8/20 0.64
NPC1 O15118 7/20 0.64
PKM P14618 3/20 0.64
SMN1; SMN2 Q16637 3/20 0.64
KMT2A Q03164 3/20 0.64
NPSR1 Q6W5P4 1/20 0.64
KDM4E B2RXH2 4/20 0.54
APP P05067 6/20 0.52
MAPT P10636 3/20 0.52
ALDH1A1 P00352 3/20 0.52
GLA P06280 2/20 0.52
GAA P10253 2/20 0.52
LMNA P02545 2/20 0.52
MMP9 P14780 2/20 0.52
MMP8 P22894 2/20 0.52
MEN1 O00255 2/20 0.49
PAX8 Q06710 1/20 0.49
NOD2 Q9HC29 1/20 0.49
L3MBTL1 Q9Y468 1/20 0.49
TNF P01375 1/20 0.49

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
SCHEMBL30665633 0.89 RAB9A (0.69) RAB9ANPC1PKMSMN1; SMN2KMT2A
SCHEMBL17879373 0.89 RAB9A (0.69) RAB9ANPC1PKMSMN1; SMN2KMT2A
SCHEMBL17038497 0.86 RAB9A (0.66) RAB9ANPC1PKMSMN1; SMN2KMT2A
SCHEMBL18680459 0.83 NPC1 (0.44) RAB9ANPC1PKMSMN1; SMN2KMT2A
SCHEMBL25796570 0.82 RAB9A (0.56) RAB9ANPC1PKMSMN1; SMN2KMT2A
SCHEMBL17038509 0.82 RAB9A (0.61) RAB9ANPC1PKMSMN1; SMN2KMT2A
SCHEMBL13008618 0.82 RAB9A (0.45) RAB9ANPC1PKMSMN1; SMN2KMT2A
SCHEMBL18680458 0.82 NPC1 (0.44) RAB9ANPC1PKMSMN1; SMN2KMT2A
SCHEMBL17038501 0.82 RAB9A (0.57) RAB9ANPC1PKMSMN1; SMN2KMT2A
SCHEMBL29528535 0.81 RAB9A (0.60) RAB9ANPC1PKMSMN1; SMN2KMT2A

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
EP-1353908-B1 PROCESSES AND SYNTHETIC INTERMEDIATES FOR PREPARING N-ARYLACRIDANCARBOXYLIC ACID DERIVATIVES LUMIGEN INC (US) 2006-03-08 EP disclosed
US-6410732-B2 FORMATION OF BOND BETWEEN NITROGEN ATOM OF ACRIDAN RING AND CARBON ATOM OF ANOTHER AROMATIC OR HETEROAROMATIC RING COMPOUND; ASSAYS FOR PEROXIDASE ENZYMES AND ENZYME INHIBITORS AND IN ASSAYS EMPLOYING ENZYME-LABELED SPECIFIC BINDING PAIRS LUMIGEN, INC. 2002-06-25 US disclosed
US-20010031869-A1 Processes and synthetic intermediates for preparing N-arylacridancarboxylic acid derivatives LUMIGEN, INC. 2001-10-18 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-20010031869-A1 Processes and synthetic intermediates for preparing N-arylacridancarboxylic acid derivatives ALDH3A1, AADAC, SPR RAB9A 4128/4885NPC1 4631/4885PKM 1391/4885

“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.