SCHEMBL3053148

SCHEMBL3053148

NCC1CN=C(c2ccccc2F)c2cc(Cl)ccc2N1

nearest known ligand 0.56

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
CHRM1 P11229 5/20 0.56
LMNA P02545 1/20 0.56
CHRM5 P08912 1/20 0.46
CCNE2 O96020 1/20 0.46
CCNE1 P24864 1/20 0.46
CDK2 P24941 1/20 0.46
TRPV1 Q8NER1 3/20 0.44
CYP3A4 P08684 1/20 0.43
AURKA O14965 1/20 0.43
GABRA1 P14867 1/20 0.42
GABRA5 P31644 1/20 0.42
GABRA3 P34903 1/20 0.42
GABRA2 P47869 1/20 0.42
GABRB2 P47870 1/20 0.42

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
SCHEMBL29516159 1.00 CHRM1 (0.56) CHRM1LMNACHRM5CCNE2CCNE1
SCHEMBL7318731 0.88 GABRA1 (0.54) CHRM1LMNACCNE2CCNE1CDK2
SCHEMBL7304407 0.87 OPRK1 (0.46) CHRM1LMNACCNE2CCNE1CDK2
SCHEMBL7305491 0.87 GABRA1 (0.43) CHRM1LMNACHRM5GABRA1GABRA5
SCHEMBL7319802 0.84 GABRA1 (0.41) CHRM1LMNACHRM5TRPV1GABRA1
Hydrochloric Acid SCHEMBL7309472 0.83 CHRM1 (0.52) CHRM1LMNACCNE2CCNE1CDK2
SCHEMBL7312454 0.81 LMNA (0.51) CHRM1LMNATRPV1
SCHEMBL7305628 0.79 LMNA (0.49) CHRM1LMNATRPV1
SCHEMBL7314804 0.79 LMNA (0.49) CHRM1LMNATRPV1
SCHEMBL7305784 0.79 CHRM1 (0.54) CHRM1LMNACHRM5CCNE2CCNE1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114292242-B Synthesis method of midazolam intermediate 宜昌天仁药业有限责任公司 2024-02-20 CN claimed
CN-114292242-A Synthesis method of midazolam intermediate 宜昌天仁药业有限责任公司 2022-04-08 CN claimed
CN-114292242-B Synthesis method of midazolam intermediate 宜昌天仁药业有限责任公司 2024-02-20 CN disclosed
CN-114292242-B Synthesis method of midazolam intermediate 宜昌天仁药业有限责任公司 2024-02-20 CN disclosed
CN-114292242-A Synthesis method of midazolam intermediate 宜昌天仁药业有限责任公司 2022-04-08 CN disclosed
CN-114292242-A Synthesis method of midazolam intermediate 宜昌天仁药业有限责任公司 2022-04-08 CN disclosed
CN-112028843-A Preparation method of 7-chloro-5- (2-fluorophenyl) -3H-1, 4-benzodiazepine-2-methylamine 北京益民药业有限公司 2020-12-04 CN disclosed
US-7776852-B2 Process for producing highly pure midazolam and salts thereof CHEMAGIS LTD. (IL) 2010-08-17 US disclosed
US-7776852-B2 Process for producing highly pure midazolam and salts thereof CHEMAGIS LTD. (IL) 2010-08-17 US disclosed
US-20090069306-A1 PROCESS FOR PRODUCING HIGHLY PURE MIDAZOLAM AND SALTS THEREOF CHEMAGIS LTD. (IL) 2009-03-12 US disclosed
US-20090069306-A1 PROCESS FOR PRODUCING HIGHLY PURE MIDAZOLAM AND SALTS THEREOF CHEMAGIS LTD. (IL) 2009-03-12 US disclosed
US-4347365-A ANTICONVULSANTS, MUSCLE RELAXANTS, SEDATIVES HOFFMANN-LA ROCHE INC. (US) 1982-08-31 US disclosed
US-4307237-A ANTICONVULSANTS, SEDATIVES, MUSCLE RELAXANTS HOFFMANN-LA ROCHE INC. (US) 1981-12-22 US disclosed
US-4280957-A Imidazodiazepines and processes therefor HOFFMANN-LA ROCHE INC. (US) 1981-07-28 US disclosed
US-RE30473-E ANTICONVULSANTS, MUSCLE RELAXANTS, SEDATIVES HOFFMANN-LA ROCHE INC. (US) 1981-01-06 US disclosed
US-4166185-A ANTICONVULSANTS, ANXIOLYTICS, SEDATIVES, MUSCLE RELAXANTS HOFFMANN-LA ROCHE INC. (US) 1979-08-28 US disclosed
US-4147875-A ANTIDEPRESSANTS, ANTICONBULSANTS, MUSCLE RELAXANTS HOFFMANN-LA ROCHE INC. (US) 1979-04-03 US disclosed
US-4146722-A SEDATIVES, MUSCLE RELAXANTS, ANTICONVULSANTS HOFFMANN-LA ROCHE INC. (US) 1979-03-27 US disclosed
US-4125726-A SEDATIVES, MUSCLE RELAXANTS, ANXIOLYTICS, ANTICONVULSANTS HOFFMANN-LA ROCHE INC. (US) 1978-11-14 US disclosed
US-4105852-A ANTICONVULSANTS, MUSCLE RELAXANTS, SEDATIVES HOFFMANN-LA ROCHE INC. (US) 1978-08-08 US 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-20090069306-A1 PROCESS FOR PRODUCING HIGHLY PURE MIDAZOLAM AND SALTS THEREOF CYP3A4, CYP3A43, CYP3A5 CHRM1 423/4885LMNA 3599/4885CHRM5 428/4885

“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.