SCHEMBL710107

SCHEMBL710107

c1ccc(-c2ccc(CNCC3C4CNCC34)cc2)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.45
KMT2A Q03164 2/20 0.45
RAB9A P51151 2/20 0.45
SMN1; SMN2 Q16637 1/20 0.43
MAN1B1 Q9UKM7 1/20 0.42
ALDH1A1 P00352 2/20 0.42
CYP1A2 P05177 1/20 0.42
CYP2D6 P10635 1/20 0.42
LMNA P02545 3/20 0.41
KDM1A O60341 1/20 0.41
HDAC1 Q13547 2/20 0.40
MC4R P32245 2/20 0.40
HTR2C P28335 1/20 0.40
SLC16A3 O15427 1/20 0.39
HTR2A P28223 1/20 0.39
DNM1 Q05193 1/20 0.38
CXCR3 P49682 1/20 0.38
EPHX2 P34913 1/20 0.38
NR1H4 Q96RI1 1/20 0.38
HTT P42858 1/20 0.37

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
SCHEMBL708596 0.87 CXCR4 (0.46) MAN1B1KDM1AMC4RHTR2C
SCHEMBL5505849 0.84 LTA4H (0.46) MEN1KMT2ASMN1; SMN2MAN1B1ALDH1A1
SCHEMBL5506772 0.74 PRMT5 (0.61) SMN1; SMN2ALDH1A1CYP1A2CYP2D6LMNA
SCHEMBL6450191 0.73 MAN1B1 (0.57) MEN1KMT2ARAB9AMAN1B1ALDH1A1
SCHEMBL15967360 0.73 CHRM2 (0.50) CYP1A2CYP2D6LMNAHDAC1HTR2C
SCHEMBL710106 0.73 HDAC3 (0.53) MEN1KMT2ARAB9ASMN1; SMN2LMNA
SCHEMBL5513134 0.72 SIGMAR1 (0.55) SMN1; SMN2ALDH1A1HTR2A
Hydrochloric Acid SCHEMBL708458 0.72 CHRM2 (0.49) CYP1A2CYP2D6LMNAHDAC1
SCHEMBL9080452 0.71 MEN1 (0.61) MEN1KMT2ARAB9ASMN1; SMN2ALDH1A1
SCHEMBL5512516 0.71 SIGMAR1 (0.54) ALDH1A1HTR2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1869019-B1 BICYCLIC [3.1.0] HETEROARYL AMIDES AS TYPE I GLYCINE TRANSPORT INHIBITORS PFIZER PROD INC (US) 2014-08-27 EP claimed
EP-1869019-B1 BICYCLIC [3.1.0] HETEROARYL AMIDES AS TYPE I GLYCINE TRANSPORT INHIBITORS PFIZER PROD INC (US) 2014-08-27 EP disclosed
US-8124639-B2 Bicyclic [3.1.0] heteroaryl amides as type 1 glycine transport inhibitors PFIZER INC. (US) 2012-02-28 US disclosed
US-20100324020-A1 Bicyclic [3.1.0] Heteroaryl Amides As Type 1 Glycine Transport Inhibitors PFIZER INC. 2010-12-23 US disclosed
US-20060229455-A1 Bicyclic [3.1.0.] heteroaryl amides as type 1 glycine transport inhibitors PFIZER INC. 2006-10-12 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 (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-20100324020-A1 Bicyclic [3.1.0] Heteroaryl Amides As Type 1 Glycine Transport Inhibitors SLC1A2, SLC1A1, SLC6A5 MEN1 3132/4885KMT2A 1400/4885RAB9A 403/4885
US-20060229455-A1 Bicyclic [3.1.0.] heteroaryl amides as type 1 glycine transport inhibitors SLC1A2, SLC1A1, GLRA1 MEN1 3305/4885KMT2A 1421/4885RAB9A 414/4885

“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.