SCHEMBL6276352

SCHEMBL6276352

CSc1ccc(Cc2cnccc2C(=O)O)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4C Q9H3R0 14/20 0.45
TBXA2R P21731 1/20 0.45
PTGER3 P43115 1/20 0.45
PTGER2 P43116 1/20 0.45
PTGDR Q13258 1/20 0.45
KDM6B O15054 6/20 0.43
KDM4E B2RXH2 2/20 0.43
KDM4A O75164 2/20 0.43
KDM4D Q6B0I6 2/20 0.43
KDM5B Q9UGL1 1/20 0.42
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
ALDH1A1 P00352 1/20 0.41
MAPT P10636 1/20 0.41
THRB P10828 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
TSHR P16473 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.40
SLC22A12 Q96S37 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
SCHEMBL6370629 0.86 PLK1 (0.46) KDM4CTBXA2RPTGER3PTGER2PTGDR
SCHEMBL6269745 0.85 KDM4E (0.48) TBXA2RPTGER3PTGER2PTGDRKDM4E
SCHEMBL4951259 0.82 KDM4C (0.56) KDM4CKDM6BKDM4EKDM4AKDM4D
SCHEMBL22189609 0.81 KDM4C (0.45) KDM4CKDM6BKDM4EKDM4AKDM4D
SCHEMBL29581046 0.81 KDM4C (0.45) KDM4CKDM6BKDM4EKDM4AKDM4D
SCHEMBL6370115 0.78 FTO (0.47) TBXA2RPTGER3PTGER2PTGDRKDM6B
SCHEMBL30100781 0.74 KDM4C (0.56) KDM4CKDM6BKDM4EKDM4AKDM4D
SCHEMBL115648 0.74 KDM4C (0.56) KDM4CKDM6BKDM4EKDM4AKDM4D
SCHEMBL6365203 0.74 SLC6A4 (0.65) MEN1KMT2AMAPTTSHRSLC6A2
SCHEMBL6364445 0.74 SLC6A4 (0.65) MEN1KMT2AMAPTTSHRSLC6A2

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-1556353-A1 DIARYL COMPOUNDS AS MONOAMINE REUPTAKE INHIBITORS Pfizer Limited (GB) 2005-07-27 EP disclosed
US-20050026920-A1 Selective serotonin re-uptake inhibitors; use in treatment of depression, attention deficit hyperactivity disorder, obsessive-compulsive disorder, post-traumatic stress disorder, substance abuse disorders and sexual dysfunction PFIZER INC 2005-02-03 US disclosed
US-6800652-B2 SELECTIVE SEROTONIN RE-UPTAKE INHIBITORS PFIZER INC. 2004-10-05 US disclosed
US-20040097509-A1 Diaryl compounds PFIZER INC. 2004-05-20 US disclosed
WO-2004016593-A1 DIARYL COMPOUNDS AS MONOAMINE REUPTAKE INHIBITORS PFIZER LIMITED (GB) 2004-02-26 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-20040097509-A1 Diaryl compounds CCNL2, CCNI, CCNA1 KDM4C 2059/4885TBXA2R 3416/4885PTGER3 2239/4885
US-20050026920-A1 Selective serotonin re-uptake inhibitors; use in treatment of depression, attention deficit hyperactivity disorder, obsessive-compulsive disorder, post-traumatic stress disorder, substance abuse disorders and sexual dysfunction SLC6A4, SLC6A2, SLC6A3 KDM4C 4125/4885TBXA2R 1479/4885PTGER3 2568/4885

“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.