SCHEMBL2006175

SCHEMBL2006175

O=C(O)CNCc1cccnc1

nearest known ligand 0.67

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 2/20 0.67
CYP2D6 P10635 1/20 0.67
NAPRT Q6XQN6 1/20 0.61
RECQL P46063 1/20 0.58
TBXAS1 P24557 8/20 0.57
CHRM2 P08172 1/20 0.56
CYP3A4 P08684 1/20 0.55
CYP2C9 P11712 1/20 0.55
CYP2C19 P33261 1/20 0.55
ALDH1A1 P00352 2/20 0.54
NPSR1 Q6W5P4 1/20 0.54
MAPT P10636 1/20 0.54
USP2 O75604 1/20 0.54
LTA4H P09960 1/20 0.53

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
SCHEMBL29653592 1.00 CYP1A2 (0.67) CYP1A2CYP2D6NAPRTRECQLTBXAS1
SCHEMBL10655526 0.92 CYP1A2 (0.61) CYP1A2CYP2D6NAPRTRECQLTBXAS1
SCHEMBL8641267 0.87 CYP1A2 (0.62) CYP1A2CYP2D6NAPRTRECQLTBXAS1
SCHEMBL3398316 0.86 CYP1A2 (0.67) CYP1A2CYP2D6NAPRTRECQLCHRM2
SCHEMBL14189533 0.85 CYP1A2 (0.65) CYP1A2CYP2D6RECQLCHRM2CYP3A4
SCHEMBL1815219 0.85 RECQL (0.66) CYP1A2CYP2D6NAPRTRECQLCHRM2
SCHEMBL29644833 0.85 RECQL (0.66) CYP1A2CYP2D6NAPRTRECQLCHRM2
SCHEMBL3722631 0.84 CHRM2 (0.67) CYP1A2CYP2D6NAPRTRECQLTBXAS1
SCHEMBL25179537 0.83 TBXAS1 (0.62) CYP1A2CYP2D6NAPRTTBXAS1CYP3A4
SCHEMBL423358 0.83 CYP1A2 (0.62) CYP1A2CYP2D6NAPRTRECQLCHRM2

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 42 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115873839-B Detection material for detecting titer of MOG antibody and preparation method thereof 成都海默云因医学检验实验室有限公司 2023-05-05 CN claimed
CN-115873839-A Detection material for detecting MOG antibody titer and preparation method thereof 成都海默云因医学检验实验室有限公司 2023-03-31 CN claimed
CN-121570485-A Application of GBP6 target in reversing cholangiocarcinoma cell gemcitabine resistance 浙江省肿瘤医院 2026-02-27 CN disclosed
US-12371454-B2 Cyclic peptide compound having Kras inhibitory action CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2025-07-29 US disclosed
CN-119300805-A Skin care compositions and methods of use 高露洁-棕榄公司 2025-01-10 CN disclosed
CN-119110720-A Cosmetic composition 布茨公司 2024-12-10 CN disclosed
US-20240400617-A1 CYCLIC PEPTIDE COMPOUND HAVING KRAS INHIBITORY ACTION CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2024-12-05 US disclosed
CN-119072299-A Cosmetic composition containing retinoid, centella asiatica extract and dipeptide 布茨公司 2024-12-03 CN disclosed
CN-118984696-A Kit of cosmetic composition 布茨公司 2024-11-19 CN disclosed
CN-118973547-A Skin care composition comprising vitamin E and vitamin B3 高露洁-棕榄公司 2024-11-15 CN disclosed
CN-118973546-A Skin care composition comprising vitamin E and vitamin B3 高露洁-棕榄公司 2024-11-15 CN disclosed
US-20090048223-A1 Sulfonamide compound ASAHI KASEI PHARMA CORPORATION (JP) 2009-02-19 US disclosed
CN-1310629-A Combined administration of ACAT and MMP inhibitors for the treatment of atherosclerotic lesions WARNER LAMBERT CO (US) 2001-08-29 CN disclosed
US-4728594-A PHOTORESISTS FOR MAKING SEMICONDUCTORS HITACHI CHEMICAL CO., LTD. (JP) 1988-03-01 US disclosed
US-4690921-A BACTERICIDES YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 1987-09-01 US disclosed
US-4608373-A BACTERICIDES, ANTIBIOTICS YAMANOUCHI PHARMACEUTICAL CO., LTD. (JP) 1986-08-26 US disclosed
EP-0189271-A2 Photosensitive composition Hitachi Chemical Co., Ltd. (JP) 1986-07-30 EP disclosed
EP-0061768-B1 N-AMIDO SUBSTITUTED DIPEPTIDES USV PHARMACEUTICAL CORPORATION (US) 1986-05-14 EP disclosed
EP-0142274-A2 Cephalosporin compounds and salts thereof, their production, and medicaments containing them YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 1985-05-22 EP disclosed
EP-0112164-A2 Cephem compounds, and their production, and medicaments containing them YAMANOUCHI PHARMACEUTICAL CO. LTD. (JP) 1984-06-27 EP 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 (3 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-20240400617-A1 CYCLIC PEPTIDE COMPOUND HAVING KRAS INHIBITORY ACTION KRAS, NRAS, HRAS CYP1A2 4845/4885CYP2D6 4576/4885NAPRT 3787/4885
US-12371454-B2 Cyclic peptide compound having Kras inhibitory action KRAS, NRAS, HRAS CYP1A2 4845/4885CYP2D6 4576/4885NAPRT 3787/4885
US-20090048223-A1 Sulfonamide compound ALK, AKT1, ARAF CYP1A2 1718/4885CYP2D6 2886/4885NAPRT 2811/4885

“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.