SCHEMBL19002955

SCHEMBL19002955

PC(c1ccccc1)(c1ccccc1)c1cccc(C(P)(c2ccccc2)c2ccccc2)c1-c1c(C(P)(c2ccccc2)c2ccccc2)cccc1C(P)(c1ccccc1)c1ccccc1

nearest known ligand 0.36

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KCNN4 O15554 6/20 0.36
TSHR P16473 2/20 0.36
ALDH1A1 P00352 2/20 0.36
MAPK1 P28482 1/20 0.32
ATM Q13315 1/20 0.31
CYP1A2 P05177 1/20 0.30
TAAR1 Q96RJ0 1/20 0.30
ALOX15 P16050 1/20 0.30

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
SCHEMBL1368134 0.87 KCNN4 (0.41) KCNN4TSHRALDH1A1MAPK1CYP1A2
SCHEMBL21530763 0.87 KCNN4 (0.31) KCNN4TSHRALDH1A1
SCHEMBL1326257 0.80 KCNN4 (0.36) KCNN4TSHRALDH1A1MAPK1CYP1A2
SCHEMBL11029195 0.79 ALDH1A1 (0.36) KCNN4TSHRALDH1A1MAPK1ATM
SCHEMBL416260 0.78 KCNN4 (0.47) KCNN4TSHRALDH1A1MAPK1CYP1A2
SCHEMBL648242 0.78 HSD17B10 (0.42) TSHRALDH1A1ATMCYP1A2ALOX15
SCHEMBL29043512 0.76 KCNN4 (0.57) KCNN4TSHRALDH1A1MAPK1CYP1A2
SCHEMBL15660504 0.76 TSHR (0.39) KCNN4TSHRALDH1A1MAPK1TAAR1
SCHEMBL15655727 0.76 KCNN4 (0.31) KCNN4TSHRALDH1A1
Bromide SCHEMBL102597 0.75 KCNN4 (0.45) KCNN4TSHRALDH1A1MAPK1CYP1A2

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-3507269-B1 STABLE HYDROFORMYLATION CATALYST FOR PREPARATION OF HIGH N/ISO RATIO ALDEHYDE PRODUCT EASTMAN CHEM CO (US) 2020-09-23 EP disclosed
US-10766833-B2 Hydroformylation method and catalyst using rhodium-ruthenium dual metal and tetradentate phosphine ligand Wuhan Catalys Technology CO., LTD (CN) 2020-09-08 US disclosed
EP-3507269-A1 STABLE HYDROFORMYLATION CATALYST FOR PREPARATION OF HIGH N/ISO RATIO ALDEHYDE PRODUCT Eastman Chemical Company (US) 2019-07-10 EP disclosed
WO-2018044827-A1 STABLE HYDROFORMYLATION CATALYST FOR PREPARATION OF HIGH N/ISO RATIO ALDEHYDE PRODUCT EASTMAN CHEMICAL COMPANY (US) 2018-03-08 WO disclosed
US-9687837-B1 Stable hydroformylation catalyst for preparation of high N/Iso ratio aldehyde product EASTMAN CHEMICAL COMPANY (US) 2017-06-27 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 (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-10766833-B2 Hydroformylation method and catalyst using rhodium-ruthenium dual metal and tetradentate phosphine ligand HRH4, PPIP5K2, NUDT1 KCNN4 2852/4885TSHR 3640/4885ALDH1A1 1224/4885

“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.