SCHEMBL19276604

SCHEMBL19276604

CCc1cc(C(=O)Nc2ccc3c(c2)OCCO3)cn(C)c1=O

nearest known ligand 0.56

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
▸ RAB9A P51151 17/20 0.56
▸ NPC1 O15118 16/20 0.56
▸ SMN1; SMN2 Q16637 4/20 0.55
▸ PKM P14618 4/20 0.55
▸ MEN1 O00255 2/20 0.55
▸ KMT2A Q03164 2/20 0.55
▸ NPSR1 Q6W5P4 1/20 0.55
▸ POLB P06746 1/20 0.53
▸ GAA P10253 1/20 0.53
▸ HSD17B10 Q99714 1/20 0.53
▸ TP53 P04637 3/20 0.53
▸ MAPT P10636 2/20 0.53
▸ GLA P06280 1/20 0.53
▸ NFKB1 P19838 1/20 0.53
▸ NFKB2 Q00653 1/20 0.53
▸ RELA Q04206 1/20 0.53
▸ ATM Q13315 1/20 0.53
▸ CYP1A2 P05177 1/20 0.52
▸ CYP3A4 P08684 1/20 0.52

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
SCHEMBL20942496 0.81 RAB9A (0.64) RAB9ANPC1SMN1; SMN2PKMMEN1
SCHEMBL20942522 0.76 NPC1 (0.64) RAB9ANPC1SMN1; SMN2PKMMEN1
SCHEMBL30926503 0.76 RAB9A (0.85) RAB9ANPC1SMN1; SMN2PKMMEN1
SCHEMBL27181112 0.76 RAB9A (0.85) RAB9ANPC1SMN1; SMN2PKMMEN1
SCHEMBL20942542 0.75 TAF1 (0.65) RAB9ANPC1SMN1; SMN2NPSR1HSD17B10
SCHEMBL30402413 0.75 TAF1 (0.65) RAB9ANPC1SMN1; SMN2NPSR1HSD17B10
SCHEMBL19276576 0.74 NPC1 (0.60) RAB9ANPC1SMN1; SMN2PKMNPSR1
SCHEMBL20942497 0.74 NPC1 (0.58) RAB9ANPC1SMN1; SMN2PKMTP53
SCHEMBL20942575 0.71 NPC1 (0.58) RAB9ANPC1SMN1; SMN2PKMKMT2A
SCHEMBL20942536 0.71 TAF1 (0.60) RAB9ANPC1SMN1; SMN2NPSR1HSD17B10

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-10702518-B2 TAF1 inhibitors for the therapy of cancer CeMM—FORSCHUNGSZENTRUM FÜR MOLEKULARE MEDIZIN GmbH (AT) 2020-07-07 — — US disclosed
US-20190117641-A1 TAF1 INHIBITORS FOR THE THERAPY OF CANCER CEMM - FORSCHUNGSZENTRUM FÜR MOLEKULARE MEDIZIN GMBH (AT) 2019-04-25 — — US disclosed
WO-2017140728-A1 TAF1 INHIBITORS FOR THE THERAPY OF CANCER CEMM - FORSCHUNGSZENTRUM FÜR MOLEKULARE MEDIZIN GMBH (AT) 2017-08-24 — — 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-20190117641-A1 TAF1 INHIBITORS FOR THE THERAPY OF CANCER TAF1, TAF1L, TAF5 RAB9A 3061/4885NPC1 2981/4885SMN1; SMN2 4029/4885
US-10702518-B2 TAF1 inhibitors for the therapy of cancer TAF1, TAF1L, TAF5 RAB9A 3061/4885NPC1 2981/4885SMN1; SMN2 4029/4885

“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.

Send feedback