SCHEMBL3319068

SCHEMBL3319068

O=S1(=O)CCN(Cc2ccccc2)CC1

nearest known ligand 0.70

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 3/20 0.68
▸ MEN1 O00255 1/20 0.68
▸ SIGMAR1 Q99720 3/20 0.65
▸ MC4R P32245 1/20 0.60
▸ LMNA P02545 3/20 0.59
▸ CYP1A2 P05177 1/20 0.57
▸ CYP2C19 P33261 1/20 0.57
▸ LTA4H P09960 1/20 0.54
▸ DRD4 P21917 1/20 0.53
▸ POLB P06746 1/20 0.53
▸ ACHE P22303 1/20 0.52
▸ CYP3A4 P08684 1/20 0.50
▸ HSD17B10 Q99714 1/20 0.50

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
SCHEMBL10416634 0.89 SIGMAR1 (0.55) KMT2AMEN1SIGMAR1MC4RLMNA
SCHEMBL2395111 0.85 RECQL (0.62) KMT2AMEN1SIGMAR1DRD4ACHE
SCHEMBL25537483 0.84 KMT2A (0.73) KMT2AMEN1LMNACYP1A2CYP2C19
SCHEMBL2479586 0.81 KMT2A (0.69) KMT2AMEN1SIGMAR1LMNACYP1A2
SCHEMBL2029947 0.81 KMT2A (0.69) KMT2AMEN1LMNACYP1A2CYP2C19
SCHEMBL10196835 0.81 KMT2A (1.00) KMT2AMEN1LMNALTA4HPOLB
SCHEMBL2064262 0.81 KMT2A (0.64) KMT2AMEN1SIGMAR1MC4RLMNA
SCHEMBL10256869 0.81 SLC6A3 (0.63) KMT2AMEN1SIGMAR1CYP1A2ACHE
SCHEMBL13982034 0.81 KMT2A (0.74) KMT2AMEN1LMNACYP1A2CYP2C19
SCHEMBL1427500 0.81 KMT2A (0.69) KMT2AMEN1LMNACYP1A2CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113087684-B Application of bis (triphenylphosphine) carbonyl ruthenium dichloride monohydrate 浙江工业大学 2022-06-21 — — CN claimed
CN-113087684-A Application of bis (triphenylphosphine) carbonyl ruthenium dichloride monohydrate 浙江工业大学 2021-07-09 — — CN claimed
CN-114583263-B Electrolyte, positive electrode, lithium ion battery and vehicle 比亚迪股份有限公司 2023-11-14 — — CN disclosed
CN-113201020-B Preparation method of bis (triphenylphosphine) carbonyl ruthenium dichloride monohydrate 浙江工业大学 2022-10-04 — — CN disclosed
CN-113087684-B Application of bis (triphenylphosphine) carbonyl ruthenium dichloride monohydrate 浙江工业大学 2022-06-21 — — CN disclosed
CN-114583263-A Electrolyte, positive electrode, lithium ion battery and vehicle 比亚迪股份有限公司 2022-06-03 — — CN disclosed
US-11279699-B2 Compound as selective JAK inhibitor, and salt and therapeutic use thereof SUZHOU LONGBIOTECH PHARMACEUTICALS CO., LTD. (CN) 2022-03-22 — — US disclosed
CN-113201020-A Preparation method of bis (triphenylphosphine) carbonyl ruthenium dichloride monohydrate 浙江工业大学 2021-08-03 — — CN disclosed
CN-113087684-A Application of bis (triphenylphosphine) carbonyl ruthenium dichloride monohydrate 浙江工业大学 2021-07-09 — — CN disclosed
US-20200190080-A1 COMPOUND AS SELECTIVE JAK INHIBITOR, AND SALT AND THERAPEUTIC USE THEREOF TIANJIN LONGBOGENE PHARMACEUTICAL CO., LTD. (CN) 2020-06-18 — — US disclosed
US-8828641-B2 Chemically amplified resist composition and patterning process SHIN-ETSU CHEMICAL CO., LTD. (JP) 2014-09-09 — — US disclosed
US-20070190041-A1 Novel benzothiazepine and bensothiepine compounds ASHAI KASEI PHARAMA CORPORATION (JP) 2007-08-16 — — US disclosed
US-7202257-B2 Anti-inflammatory medicaments DECIPHERA PHARMACEUTICALS, LLC (US) 2007-04-10 — — US disclosed
US-7202257-B2 Anti-inflammatory medicaments DECIPHERA PHARMACEUTICALS, LLC (US) 2007-04-10 — — US disclosed
US-20070037808-A1 p38 kinase inhibitors DECIPHERA PHARMACEUTICALS, LLC 2007-02-15 — — US disclosed
US-20070037808-A1 p38 kinase inhibitors DECIPHERA PHARMACEUTICALS, LLC 2007-02-15 — — US disclosed
US-20050192297-A1 Quinazolinone compounds with reduced bioaccumulation CHIRON CORPORATION GLAXOSMITHKLINE 2005-09-01 — — US disclosed
US-20050059662-A1 Substituted quinazolinone compounds CHIRON CORPORATION 2005-03-17 — — US disclosed
US-6670366-B1 Cyclic guanosine 3',5'-monophosphate phosphodiesterase inhibitors; impotence; pyrazolo(4,3-d)pyrimidin-7-ones PFIZER INC 2003-12-30 — — US disclosed
EP-0995750-A1 Pyrazolopyrimidinone cGMP PDE5 inhibitors for the treatment of sexual dysfunction PFIZER INC. (US) 2000-04-26 — — 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 (6 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-20050059662-A1 Substituted quinazolinone compounds MC4R, MC2R, MC3R KMT2A 4434/4885MEN1 549/4885SIGMAR1 1329/4885
US-20070037808-A1 p38 kinase inhibitors MAPK1, MAP3K8, MAP3K1 KMT2A 3389/4885MEN1 4811/4885SIGMAR1 1319/4885
US-20050192297-A1 Quinazolinone compounds with reduced bioaccumulation MC4R, MC2R, MC3R KMT2A 3925/4885MEN1 585/4885SIGMAR1 348/4885
US-20200190080-A1 COMPOUND AS SELECTIVE JAK INHIBITOR, AND SALT AND THERAPEUTIC USE THEREOF JAK1, JAK2, JAK3 KMT2A 383/4885MEN1 2505/4885SIGMAR1 1288/4885
US-11279699-B2 Compound as selective JAK inhibitor, and salt and therapeutic use thereof JAK1, JAK2, JAK3 KMT2A 383/4885MEN1 2505/4885SIGMAR1 1288/4885
US-20070190041-A1 Novel benzothiazepine and bensothiepine compounds SLC10A1, GOT1, CES1 KMT2A 486/4885MEN1 3722/4885SIGMAR1 161/4885

“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