SCHEMBL7899889

SCHEMBL7899889

COc1ccc(CCCC(N)=O)cc1[N+](=O)[O-]

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 11/20 0.58
LMNA P02545 2/20 0.58
GAA P10253 1/20 0.58
HTT P42858 1/20 0.58
SMN1; SMN2 Q16637 2/20 0.53
MAPT P10636 4/20 0.50
CYP1A2 P05177 1/20 0.50
CYP3A4 P08684 1/20 0.50
CYP2C19 P33261 1/20 0.50
MEN1 O00255 2/20 0.49
KMT2A Q03164 2/20 0.49
NPC1 O15118 1/20 0.48
RAB9A P51151 1/20 0.48
PKM P14618 1/20 0.47
PLAAT3 P53816 1/20 0.47
PLAAT5 Q96KN8 1/20 0.47
PLAAT2 Q9NWW9 1/20 0.47
PLAAT4 Q9UL19 1/20 0.47
GRIN2D O15399 1/20 0.47
GRIN3B O60391 1/20 0.47

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
SCHEMBL6984451 0.85 ALDH1A1 (0.55) ALDH1A1LMNAGAAHTTSMN1; SMN2
SCHEMBL2742576 0.85 ALDH1A1 (0.62) ALDH1A1LMNAGAAHTTSMN1; SMN2
SCHEMBL31090163 0.84 SMN1; SMN2 (0.61) ALDH1A1LMNAGAAHTTSMN1; SMN2
SCHEMBL10782766 0.83 ALDH1A1 (0.60) ALDH1A1LMNAGAAHTTSMN1; SMN2
SCHEMBL20718833 0.83 ALDH1A1 (0.54) ALDH1A1LMNAGAAHTTSMN1; SMN2
SCHEMBL2224074 0.82 ATM (0.61) ALDH1A1KMT2APLAAT3PLAAT5PLAAT2
SCHEMBL3949693 0.82 ALDH1A1 (0.58) ALDH1A1LMNAGAAHTTSMN1; SMN2
SCHEMBL498428 0.82 SMN1; SMN2 (0.57) ALDH1A1LMNAGAAHTTSMN1; SMN2
SCHEMBL2742574 0.81 ALDH1A1 (0.61) ALDH1A1LMNAGAAHTTSMN1; SMN2
SCHEMBL8867007 0.81 SMN1; SMN2 (0.67) ALDH1A1LMNAGAAHTTSMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3441389-B1 PYRAZOLE-OXAZOLIDINONE COMPOUND FOR ANTI-HEPATITIS B VIRUS SHANGHAI ZHIMENG BIOPHARMA INC (CN) 2021-09-08 EP disclosed
CN-109311865-B Pyrazole-oxazolidinone compound for resisting hepatitis B virus 上海挚盟医药科技有限公司 2021-08-31 CN disclosed
US-20190152963-A1 PYRAZOLE-OXAZOLIDINONE COMPOUND FOR ANTI-HEPATITIS B VIRUS SHANGHAI ZHIMENG BIOPHARMA, INC. (CN) 2019-05-23 US disclosed
EP-3441389-A1 PYRAZOLE-OXAZOLIDINONE COMPOUND FOR ANTI-HEPATITIS B VIRUS Shanghai Zhimeng Biopharma Co., Ltd (CN) 2019-02-13 EP disclosed
US-6232498-B1 NOVEL CHEMICAL INTERMEDIATE ASTRA ZENECA UK LIMITED (GB) 2001-05-15 US disclosed
US-6194614-B1 Process for the preparation of benzothiazolone compounds ASTRAZENECA UK LIMITED (GB) 2001-02-27 US disclosed
US-6147219-A Process for the preparation of benzothiazolone compounds ASTRAZENECA UK LIMITED (GB) 2000-11-14 US disclosed
US-6124468-A 7(2-ACETAMINOETHYL)-2-AMINO-4-METHOXYBENZOTHIAZINE INTERMEDIATE ASTRAZENECA UK LIMITED (GB) 2000-09-26 US disclosed
US-6118024-A Process for the preparation of benzothiazolone compounds ASTRAZENECA UK LIMITED (GB) 2000-09-12 US disclosed
US-6114578-A Process for the preparation of benzothiazolone compounds ASTRAZENECA UK LIMITED (GB) 2000-09-05 US disclosed
US-6087508-A Process for the preparation of benzothiazolone compounds ASTRAZENECA UK LIMITED (GB) 2000-07-11 US disclosed
EP-0970064-A1 PROCESS FOR THE PREPARATION OF BENZOTHIAZOLONE COMPOUNDS Astra Pharmaceuticals Limited (GB) 2000-01-12 EP disclosed
WO-1998038180-A1 PROCESS FOR THE PREPARATION OF BENZOTHIAZOLONE COMPOUNDS ASTRA PHARMACEUTICALS LTD. (GB) 1998-09-03 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-20190152963-A1 PYRAZOLE-OXAZOLIDINONE COMPOUND FOR ANTI-HEPATITIS B VIRUS HAVCR2, ZC3HAV1, ZC3HAV1L ALDH1A1 795/4885LMNA 3781/4885GAA 3206/4885

“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.