Pptn

Pptn

SCHEMBL2934979

CS(=O)(=O)O.O=C(O)c1cc(-c2ccc(C3CCNCC3)cc2)c2ccc(-c3ccc(C(F)(F)F)cc3)cc2c1

nearest known ligand 0.89

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ABL1ADRA1AADRA1BADRA1DADRA2AADRA2BADRA2CADRB2AGTR1BCL2BCL2A1BCL2L1BCL2L10BCL2L2BCRBRAFCHRM1CHRNA10CHRNA9DRD1DRD2DRD3DRD4DRD5EGFRF2FLT1FLT4GCKGHSRGNRHRGRIN1GRIN2AGRIN2BGRIN2CGRIN2DGRIN3AGRIN3BHTR1AHTR1BHTR1DHTR2AHTR2CHTR3AIDH2KDRKITMAOBMCL1MTTPPP4HBPDGFRBPIK3CAPIK3CBPIK3CDPIK3CGPIK3R1PIK3R2PIK3R3PIK3R5PIKFYVEROCK1ROCK2SLC18A2SLC6A2SLC6A3SLC6A4TACR1TUBA1ATUBA1BTUBA1CTUBA3CTUBA3ETUBA4ATUBBTUBB1TUBB2ATUBB2BTUBB3TUBB4ATUBB4BTUBB6TUBB8gyrAgyrBparCparEpol

The experimentally established mechanism targets of Pptn. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD5 known ✓ P21918 4/20 0.89
DRD3 known ✓ P35462 3/20 0.89
DRD1 known ✓ P21728 3/20 0.89
HTR1A known ✓ P08908 2/20 0.89
SLC6A2 known ✓ P23975 2/20 0.89
AGTR1 known ✓ P30556 2/20 0.89
SLC6A3 known ✓ Q01959 2/20 0.89
ADRA2C known ✓ P18825 2/20 0.89
ADRA2A known ✓ P08913 2/20 0.89
ADRA1B known ✓ P35368 2/20 0.89
EGFR known ✓ P00533 1/20 0.89
ADRA2B known ✓ P18089 1/20 0.89
SLC6A4 known ✓ P31645 1/20 0.89
SLC18A2 known ✓ Q05940 1/20 0.89
HTR1B known ✓ P28222 2/20 0.88
HTR1D known ✓ P28221 2/20 0.88
ADRB2 known ✓ P07550 1/20 0.88
HTR2A known ✓ P28223 1/20 0.83
ADRA1A known ✓ P35348 1/20 0.69
P2RY14 Q15391 19/20 0.89

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
Pptn SCHEMBL13057620 0.94 P2RY14 (1.00) P2RY14TMEM97DRD5DRD3ADRB3
Pptn SCHEMBL31722460 0.93 P2RY14 (1.00) P2RY14TMEM97DRD5DRD3ADRB3
SCHEMBL30608323 0.91 P2RY14 (1.00) P2RY14TMEM97DRD5DRD3ADRB3
SCHEMBL30608308 0.89 P2RY14 (1.00) P2RY14TMEM97DRD5DRD3ADRB3
SCHEMBL2932404 0.88 P2RY14 (0.69) P2RY14TMEM97DRD5DRD3ADRB3
SCHEMBL26033092 0.88 P2RY14 (0.83) P2RY14TMEM97DRD5DRD3ADRB3
SCHEMBL2934980 0.88 P2RY14 (0.74) P2RY14TMEM97DRD5DRD3ADRB3
SCHEMBL22996061 0.87 P2RY14 (0.79) P2RY14TMEM97DRD5DRD3ADRB3
SCHEMBL30608298 0.85 P2RY14 (1.00) P2RY14TMEM97DRD5DRD3ADRB3
SCHEMBL30608305 0.85 P2RY14 (1.00) P2RY14TMEM97DRD5DRD3ADRB3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100298347-A1 SUBSTITUTED 2-NAPHTHOIC ACIDS AS ANTAGONISTS OF GPR105 ACTIVITY MERCK FROSST CANADA LTD (CA) 2010-11-25 US disclosed
EP-2229373-A1 SUBSTITUTED 2-NAPHTHOIC ACIDS AS ANTAGONISTS OF GPR105 ACTIVITY Merck Frosst Canada Ltd. (CA) 2010-09-22 EP disclosed
WO-2009070873-A1 SUBSTITUTED 2-NAPHTHOIC ACIDS AS ANTAGONISTS OF GPR105 ACTIVITY MERCK FROSST CANADA LTD. (CA) 2009-06-11 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 (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-20100298347-A1 SUBSTITUTED 2-NAPHTHOIC ACIDS AS ANTAGONISTS OF GPR105 ACTIVITY GPR119, GPR52, GPR35 DRD5 1185/4885DRD3 3705/4885DRD1 3386/4885

“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.