SCHEMBL3923237

SCHEMBL3923237

OC(CBr)c1cc(OCc2ccccc2)cc(OCc2ccccc2)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.53
MEN1 O00255 2/20 0.53
SMN1; SMN2 Q16637 2/20 0.49
RRM1 P23921 1/20 0.48
LMNA P02545 2/20 0.47
CYP1A2 P05177 2/20 0.47
PTGS1 P23219 1/20 0.47
SLC6A2 P23975 1/20 0.47
CYP2C19 P33261 1/20 0.47
PTGS2 P35354 1/20 0.47
SLC6A3 Q01959 1/20 0.47
HIF1A Q16665 1/20 0.47
HDAC6 Q9UBN7 1/20 0.47
MAOB P27338 2/20 0.46
HPGD P15428 1/20 0.45
ALOX15 P16050 1/20 0.45
TSHR P16473 1/20 0.45
MAPK1 P28482 1/20 0.45
HTT P42858 1/20 0.45
ALOX5 P09917 1/20 0.45

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
SCHEMBL13840614 1.00 KMT2A (0.53) KMT2AMEN1SMN1; SMN2RRM1LMNA
SCHEMBL9967892 0.90 GRM5 (0.47) KMT2AMEN1SMN1; SMN2RRM1LMNA
SCHEMBL3443080 0.89 KMT2A (0.58) KMT2AMEN1SMN1; SMN2LMNAMAOB
SCHEMBL8481818 0.85 LMNA (0.58) SMN1; SMN2LMNACYP1A2PTGS1SLC6A2
SCHEMBL8482579 0.85 LMNA (0.58) SMN1; SMN2LMNACYP1A2PTGS1SLC6A2
SCHEMBL20175852 0.85 MEN1 (0.50) KMT2AMEN1LMNAMAOBSGMS2
SCHEMBL11271196 0.84 MAPT (0.44) KMT2AMEN1SMN1; SMN2LMNAMAOB
SCHEMBL7145799 0.84 KMT2A (0.53) KMT2AMEN1SMN1; SMN2RRM1LMNA
SCHEMBL10477884 0.84 KMT2A (0.53) KMT2AMEN1SMN1; SMN2RRM1LMNA
SCHEMBL393316 0.84 LMNA (0.56) KMT2AMEN1LMNACYP1A2PTGS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112250586-A Preparation method of terbutaline sulfate and B crystal form thereof 福安药业集团宁波天衡制药有限公司 2021-01-22 CN claimed
CN-112250586-A Preparation method of terbutaline sulfate and B crystal form thereof 福安药业集团宁波天衡制药有限公司 2021-01-22 CN disclosed
US-20100168245-A1 PREPARATION OF (R,R)-FENOTEROL AND (R,R)-OR (R,S)-FENOTEROL ANALOGUES AND THEIR USE IN TREATING CONGESTIVE HEART FAILURE THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES 2010-07-01 US disclosed
EP-1730141-B1 COMPOUNDS FOR THE TREATMENT OF DISEASES PFIZER LTD (GB) 2009-05-27 EP disclosed
US-7538141-B2 Compounds for the treatment of diseases PFIZER INC. 2009-05-26 US disclosed
EP-1730141-A1 COMPOUNDS FOR THE TREATMENT OF DISEASES Pfizer Limited (GB) 2006-12-13 EP disclosed
US-20050222128-A1 Compounds for the treatment of diseases PFIZER INC 2005-10-06 US disclosed
WO-2005092887-A1 COMPOUNDS FOR THE TREATMENT OF DISEASES PFIZER LIMITED (GB) 2005-10-06 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 (2 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-20100168245-A1 PREPARATION OF (R,R)-FENOTEROL AND (R,R)-OR (R,S)-FENOTEROL ANALOGUES AND THEIR USE IN TREATING CONGESTIVE HEART FAILURE ADRB2, ADRB1, ADRB3 KMT2A 4127/4885MEN1 4799/4885SMN1; SMN2 3677/4885
US-20050222128-A1 Compounds for the treatment of diseases LTC4S, LTB4R2, CYP11B2 KMT2A 3620/4885MEN1 975/4885SMN1; SMN2 1291/4885

“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.