SCHEMBL6987747

SCHEMBL6987747

c1ccc2c(c1)CCn1ccnc1C2=C1CCNCC1

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HRH1 P35367 11/20 0.62
HTR2C P28335 4/20 0.43
HTR2A P28223 3/20 0.43
ADRA1A P35348 3/20 0.43
HTR2B P41595 3/20 0.43
ADRA1B P35368 1/20 0.43
CHRM2 P08172 2/20 0.41
HTR1A P08908 2/20 0.41
CHRM1 P11229 2/20 0.41
DRD2 P14416 2/20 0.41
OPRK1 P41145 2/20 0.41
KCNH2 Q12809 2/20 0.41
HRH4 Q9H3N8 6/20 0.40
LMNA P02545 2/20 0.40
SETD7 Q8WTS6 1/20 0.40
MEN1 O00255 1/20 0.40
ADRB2 P07550 1/20 0.40
CHRM4 P08173 1/20 0.40
ABCB1 P08183 1/20 0.40
CHRM5 P08912 1/20 0.40

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
SCHEMBL5060507 0.85 SETD7 (0.59) HRH1HTR2CHTR2AADRA1AHTR2B
SCHEMBL6988125 0.83 HRH1 (0.58) HRH1HTR2CHTR2AADRA1AHTR2B
SCHEMBL6987948 0.81 HRH1 (0.47) HRH1HTR2CHTR2AADRA1AHTR2B
SCHEMBL25779928 0.80 KDM4E (0.44) HRH1HTR2CHTR2AADRA1AHTR2B
SCHEMBL30561615 0.80 KDM4E (0.44) HRH1HTR2CHTR2AADRA1AHTR2B
SCHEMBL6995295 0.79 HRH1 (0.43) HRH1HTR2CHTR2AADRA1AHTR2B
SCHEMBL9167967 0.79 PTAFR (0.64) HRH1PTAFRFNTAFNTB
SCHEMBL6991281 0.79 HRH1 (0.43) HRH1HTR2CHTR2AADRA1AHTR2B
SCHEMBL6989791 0.78 HRH1 (0.40) HRH1HTR2CHTR2AADRA1AHTR2B
SCHEMBL6984394 0.78 HRH1 (0.42) HRH1HTR2CHTR2AADRA1AHTR2B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0518435-A1 Imidazo[2,1-b][3]benzazepine derivatives, compositions and method of use JANSSEN PHARMACEUTICA N.V. (BE) 1992-12-16 EP claimed
US-9650385-B2 Polymorphic form of alcaftadine, composition and process ENALTEC LABS PVT. LTD. (IN) 2017-05-16 US disclosed
US-9650385-B2 Polymorphic form of alcaftadine, composition and process ENALTEC LABS PVT. LTD. (IN) 2017-05-16 US disclosed
US-9580436-B2 Process of preparing alcaftadine ENALTEC LABS PRIVATE LIMITED (IN) 2017-02-28 US disclosed
US-9580436-B2 Process of preparing alcaftadine ENALTEC LABS PRIVATE LIMITED (IN) 2017-02-28 US disclosed
US-20160362413-A1 POLYMORPHIC FORM OF ALCAFTADINE, COMPOSITION AND PROCESS ENALTEC LABS PVT. LTD. (IN) 2016-12-15 US disclosed
US-20160362413-A1 POLYMORPHIC FORM OF ALCAFTADINE, COMPOSITION AND PROCESS ENALTEC LABS PVT. LTD. (IN) 2016-12-15 US disclosed
US-9409913-B2 Polymorphic forms of alcaftadine ENALTEC LABS PRIVATE LIMITED (IN) 2016-08-09 US disclosed
US-9409913-B2 Polymorphic forms of alcaftadine ENALTEC LABS PRIVATE LIMITED (IN) 2016-08-09 US disclosed
US-20160083389-A1 PROCESS OF PREPARING ALCAFTADINE ENALTEC LABS PVT. LTD. (IN) 2016-03-24 US disclosed
EP-0552292-B1 SUBSTITUTED IMIDAZOBENZAZEPINES AND IMIDAZOPYRIDOAZEPINES SCHERING CORP (US) 1995-06-21 EP disclosed
US-5393753-A Antiallergens, antiinflammatory agents SCHERING CORPORATION (US) 1995-02-28 US disclosed
EP-0588858-A1 IMIDAZO 2,1-b] 3]BENZAZEPINE DERIVATIVES, COMPOSITIONS AND METHOD OF USE JANSSEN PHARMACEUTICA N.V. (BE) 1994-03-30 EP disclosed
EP-0588858-A1 IMIDAZO 2,1-b] 3]BENZAZEPINE DERIVATIVES, COMPOSITIONS AND METHOD OF USE JANSSEN PHARMACEUTICA N.V. (BE) 1994-03-30 EP disclosed
EP-0552292-A1 SUBSTITUTED IMIDAZOBENZAZEPINES AND IMIDAZOPYRIDOAZEPINES. SCHERING CORP (US) 1993-07-28 EP disclosed
WO-1992022551-A1 IMIDAZO[2,1-b][3]BENZAZEPINE DERIVATIVES, COMPOSITIONS AND METHOD OF USE JANSSEN PHARMACEUTICA N.V. (BE) 1992-12-23 WO disclosed
WO-1992022551-A1 IMIDAZO[2,1-b][3]BENZAZEPINE DERIVATIVES, COMPOSITIONS AND METHOD OF USE JANSSEN PHARMACEUTICA N.V. (BE) 1992-12-23 WO disclosed
EP-0518435-A1 Imidazo[2,1-b][3]benzazepine derivatives, compositions and method of use JANSSEN PHARMACEUTICA N.V. (BE) 1992-12-16 EP disclosed
EP-0518435-A1 Imidazo[2,1-b][3]benzazepine derivatives, compositions and method of use JANSSEN PHARMACEUTICA N.V. (BE) 1992-12-16 EP disclosed
WO-1992006981-A1 SUBSTITUTED IMIDAZOBENZAZEPINES AND IMIDAZOPYRIDOAZEPINES SCHERING CORPORATION (US) 1992-04-30 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-20160083389-A1 PROCESS OF PREPARING ALCAFTADINE CYP4F2, CYP2F1, CYP1A2 HRH1 1121/4885HTR2C 853/4885HTR2A 746/4885
US-20160362413-A1 POLYMORPHIC FORM OF ALCAFTADINE, COMPOSITION AND PROCESS ADRA2C, UGT1A1, ADRA2A HRH1 428/4885HTR2C 450/4885HTR2A 268/4885

“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.