SCHEMBL22803293

SCHEMBL22803293

Cc1nc2cc(NC(=O)NC3CC4CCC(C4)C3)ccc2s1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 9/20 0.50
NPC1 O15118 7/20 0.50
TRPV1 Q8NER1 2/20 0.50
CASP3 P42574 1/20 0.50
SENP7 Q9BQF6 1/20 0.50
KDM4E B2RXH2 4/20 0.48
MAPT P10636 2/20 0.48
LMNA P02545 1/20 0.47
P2RX7 Q99572 1/20 0.47
POLB P06746 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
LDHA P00338 1/20 0.46
EPHX2 P34913 1/20 0.46
GAA P10253 2/20 0.46
SMN1; SMN2 Q16637 5/20 0.45
TP53 P04637 1/20 0.45
KMT2A Q03164 2/20 0.45
MEN1 O00255 1/20 0.45
ALDH1A1 P00352 1/20 0.45
TSHR P16473 1/20 0.44

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
SCHEMBL5528895 0.86 EPHX2 (0.61) RAB9ANPC1TRPV1CASP3SENP7
SCHEMBL3958695 0.80 EPHX2 (0.63) RAB9ANPC1MAPTLMNAP2RX7
SCHEMBL16248331 0.77 NPC1 (0.60) RAB9ANPC1TRPV1CASP3SENP7
SCHEMBL14470416 0.77 EPHX2 (0.75) RAB9ANPC1KDM4EMAPTPOLB
SCHEMBL14470486 0.77 RAB9A (0.56) RAB9ANPC1TRPV1CASP3SENP7
SCHEMBL5798843 0.76 RAB9A (0.65) RAB9ANPC1TRPV1CASP3SENP7
SCHEMBL3323465 0.75 P2RX7 (0.69) RAB9ANPC1TRPV1CASP3SENP7
SCHEMBL4011536 0.75 LDHA (0.78) RAB9ANPC1TRPV1CASP3SENP7
SCHEMBL6306822 0.74 RAB9A (0.64) RAB9ANPC1TRPV1CASP3SENP7
SCHEMBL4920329 0.74 TRPV1 (0.65) RAB9ANPC1TRPV1CASP3SENP7

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-20230106899-A1 METHODS OF TREATING CANCER NOVARTIS PHARMA AG (CH) 2023-04-06 US disclosed
WO-2020257621-A1 METHODS OF TREATING CANCER IFM DUE, INC. (US) 2020-12-24 WO disclosed
WO-2020252240-A1 COMPOUNDS AND COMPOSITIONS FOR TREATING CONDITIONS ASSOCIATED WITH STING ACTIVITY IFM DUE, INC. (US) 2020-12-17 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 (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-20230106899-A1 METHODS OF TREATING CANCER STING1, CGAS, TBK1 RAB9A 1457/4885NPC1 249/4885TRPV1 2675/4885

“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.