SCHEMBL16207702

SCHEMBL16207702

c1cc(-n2cc(C3CC3)nn2)ccc1OC1CCN(C2CCC2)CC1

nearest known ligand 0.48

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MIF P14174 1/20 0.48
HRH3 Q9Y5N1 18/20 0.47
KCNH2 Q12809 2/20 0.47
CA12 O43570 1/20 0.44
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
CA9 Q16790 1/20 0.44

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
SCHEMBL16215853 0.82 HRH3 (0.58) HRH3KCNH2
SCHEMBL16207699 0.82 P2RX7 (0.54) HRH3KCNH2
SCHEMBL16207739 0.81 HRH3 (0.48) HRH3KCNH2
Hydrochloric Acid SCHEMBL16207754 0.81 HRH3 (0.57) HRH3KCNH2
SCHEMBL16207745 0.81 ACKR3 (0.51) HRH3KCNH2
SCHEMBL16207620 0.81 HRH3 (0.50) MIFHRH3
SCHEMBL16207696 0.80 ACKR3 (0.53) HRH3
SCHEMBL16207762 0.80 HRH3 (0.47) HRH3KCNH2
SCHEMBL16207579 0.80 HRH3 (0.48) HRH3KCNH2
Hydrochloric Acid SCHEMBL16207786 0.80 ACKR3 (0.50) HRH3KCNH2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20150045553-A1 PHENYLTRIAZOLE DERIVATIVE TAISHO PHARMACEUTICAL CO., LTD (JP) 2015-02-12 US disclosed
US-20150045553-A1 PHENYLTRIAZOLE DERIVATIVE TAISHO PHARMACEUTICAL CO., LTD (JP) 2015-02-12 US disclosed
US-20150045553-A1 PHENYLTRIAZOLE DERIVATIVE TAISHO PHARMACEUTICAL CO., LTD (JP) 2015-02-12 US disclosed
EP-2799436-A1 PHENYLTRIAZOLE DERIVATIVE Taisho Pharmaceutical Co., Ltd. (JP) 2014-11-05 EP 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-20150045553-A1 PHENYLTRIAZOLE DERIVATIVE PER2, BACE1, MAPT MIF 3131/4885HRH3 56/4885KCNH2 1119/4885

“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.