SCHEMBL19002947

SCHEMBL19002947

Cc1ccccc1-c1cc(C)c(-c2ccccc2C)cc1C

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.50
ACHE P22303 1/20 0.50
DHFR P00374 1/20 0.48
NPC1 O15118 2/20 0.46
RAB9A P51151 2/20 0.46
SMN1; SMN2 Q16637 2/20 0.46
CASP3 P42574 1/20 0.46
SENP8 Q96LD8 1/20 0.46
SENP7 Q9BQF6 1/20 0.46
SENP6 Q9GZR1 1/20 0.46
PLA2G7 Q13093 4/20 0.43
LMNA P02545 2/20 0.42
BRD4 O60885 1/20 0.42
LDHA P00338 1/20 0.41
HTR7 P34969 1/20 0.41
MYC P01106 1/20 0.40
NQO2 P16083 1/20 0.40
GAA P10253 1/20 0.40
IDO1 P14902 1/20 0.40
METAP2 P50579 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
SCHEMBL30951307 1.00 TSHR (0.50) TSHRACHEDHFRNPC1RAB9A
SCHEMBL30354037 0.87 ACHE (0.64) TSHRACHENPC1RAB9ASMN1; SMN2
SCHEMBL197690 0.87 ACHE (0.64) TSHRACHENPC1RAB9ASMN1; SMN2
SCHEMBL30169568 0.87 ACHE (0.64) TSHRACHENPC1RAB9ASMN1; SMN2
SCHEMBL19897389 0.86 ALDH1A1 (0.46) TSHRACHEDHFRNPC1RAB9A
SCHEMBL16062614 0.85 DHFR (0.47) TSHRACHEDHFRNPC1RAB9A
Ammonia Solution, Strong SCHEMBL842431 0.84 ACHE (0.60) TSHRACHENPC1RAB9ASMN1; SMN2
Lithium SCHEMBL31260773 0.84 ACHE (0.60) TSHRACHENPC1RAB9ASMN1; SMN2
SCHEMBL6564122 0.84 ACHE (0.60) TSHRACHENPC1RAB9ASMN1; SMN2
SCHEMBL19650170 0.82 DHFR (0.39) TSHRACHEDHFRNPC1RAB9A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3507263-B1 EFFICIENT CATALYST FOR THE FORMATION OF POLYARYL HYDROCARBONS SUITABLE AS PRECURSORS FOR POLYDENTATE ORGANOPHOSPHORUS CATALYST LIGANDS EASTMAN CHEM CO (US) 2024-06-19 EP disclosed
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-9975833-B2 Efficient catalyst for the formation of polyaryl hydrocarbons suitable as precursors for polydentate organophosphorus catalyst ligands EASTMAN CHEMICAL COMPANY (US) 2018-05-22 US disclosed
US-9975833-B2 Efficient catalyst for the formation of polyaryl hydrocarbons suitable as precursors for polydentate organophosphorus catalyst ligands EASTMAN CHEMICAL COMPANY (US) 2018-05-22 US disclosed
WO-2018044824-A1 EFFICIENT CATALYST FOR THE FORMATION OF POLYARYL HYDROCARBONS SUITABLE AS PRECURSORS FOR POLYDENTATE ORGANOPHOSPHORUS CATALYST LIGANDS EASTMAN CHEMICAL COMPANY (US) 2018-03-08 WO disclosed
US-20180057435-A1 EFFICIENT CATALYST FOR THE FORMATION OF POLYARYL HYDROCARBONS SUITABLE AS PRECURSORS FOR POLYDENTATE ORGANOPHOSPHORUS CATALYST LIGANDS EASTMAN CHEMICAL COMPANY (US) 2018-03-01 US disclosed
US-20180057435-A1 EFFICIENT CATALYST FOR THE FORMATION OF POLYARYL HYDROCARBONS SUITABLE AS PRECURSORS FOR POLYDENTATE ORGANOPHOSPHORUS CATALYST LIGANDS EASTMAN CHEMICAL COMPANY (US) 2018-03-01 US 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
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-20180057435-A1 EFFICIENT CATALYST FOR THE FORMATION OF POLYARYL HYDROCARBONS SUITABLE AS PRECURSORS FOR POLYDENTATE ORGANOPHOSPHORUS CATALYST LIGANDS DDT, HDHD5, HPD TSHR 1436/4885ACHE 70/4885DHFR 353/4885

“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.