SCHEMBL19640337

SCHEMBL19640337

COc1[c]cc(C(=O)NC2CCC2)cc1

nearest known ligand 0.50

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
NPC1 O15118 5/20 0.50
RAB9A P51151 5/20 0.50
SMN1; SMN2 Q16637 3/20 0.50
HPGD P15428 2/20 0.50
KMT2A Q03164 2/20 0.50
MEN1 O00255 1/20 0.50
CYP1A2 P05177 1/20 0.50
CYP2C19 P33261 1/20 0.50
NPSR1 Q6W5P4 1/20 0.45
GRM5 P41594 1/20 0.44
CYP2D6 P10635 1/20 0.44
CYP2C9 P11712 1/20 0.44
USP2 O75604 1/20 0.43
MAPK1 P28482 1/20 0.43
OPRK1 P41145 1/20 0.43
TSHR P16473 1/20 0.43

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
SCHEMBL19640326 0.96 NPC1 (0.56) NPC1RAB9ASMN1; SMN2HPGDKMT2A
SCHEMBL9900395 0.81 RAB9A (0.58) NPC1RAB9ASMN1; SMN2HPGDKMT2A
SCHEMBL17749779 0.80 HPGD (0.42) NPC1RAB9ASMN1; SMN2HPGDKMT2A
SCHEMBL17749725 0.76 TDP1 (0.50) SMN1; SMN2HPGDKMT2AMEN1CYP2C9
SCHEMBL16583908 0.75 NPC1 (0.63) NPC1RAB9ASMN1; SMN2HPGDKMT2A
SCHEMBL2237100 0.74 RAB9A (0.53) NPC1RAB9ASMN1; SMN2HPGDKMT2A
SCHEMBL17749739 0.74 MMP13 (0.49) NPC1RAB9ASMN1; SMN2HPGDKMT2A
SCHEMBL19640304 0.74 KDM4E (0.47) NPC1RAB9ASMN1; SMN2HPGDKMT2A
SCHEMBL9900580 0.74 NPC1 (0.65) NPC1RAB9ASMN1; SMN2HPGDKMT2A
SCHEMBL299808 0.73 CA1 (0.52) RAB9ASMN1; SMN2HPGDKMT2AMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116003409-A Substituted pyrrolopyridines as bromodomain inhibitors 基因泰克公司 2023-04-25 CN disclosed
CN-107207493-B Substituted pyrrolopyridines as bromodomain inhibitors 基因泰克公司 2023-01-20 CN disclosed
CN-115583947-A Substituted pyrrolopyridines as bromodomain inhibitors 基因泰克公司 2023-01-10 CN disclosed
US-10183009-B2 Therapeutic compounds and uses thereof GENENTECH, INC. (US) 2019-01-22 US disclosed
US-20170340605-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF GENENTECH, INC. (US) 2017-11-30 US disclosed
CN-107207493-A Substituted pyrrolopyridines as bromodomain inhibitors 基因泰克公司 2017-09-26 CN 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-10183009-B2 Therapeutic compounds and uses thereof BRD4, BRDT, BRPF3 NPC1 1302/4885RAB9A 1868/4885SMN1; SMN2 1340/4885
US-20170340605-A1 THERAPEUTIC COMPOUNDS AND USES THEREOF BRD4, BRDT, BRPF3 NPC1 1302/4885RAB9A 1868/4885SMN1; SMN2 1340/4885

“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.