SCHEMBL9704887

SCHEMBL9704887

CC[C](O)Oc1ccc(N)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 7/20 0.50
TSHR P16473 3/20 0.50
MAPK1 P28482 1/20 0.44
ALDH1A1 P00352 4/20 0.43
CYP3A4 P08684 4/20 0.43
MAOA P21397 3/20 0.41
CYP19A1 P11511 2/20 0.41
MAPT P10636 4/20 0.40
RAB9A P51151 4/20 0.40
NPC1 O15118 3/20 0.40
TEAD4 Q15561 1/20 0.40
ESR1 P03372 2/20 0.40
ESR2 Q92731 1/20 0.40
SMN1; SMN2 Q16637 4/20 0.39
GAA P10253 2/20 0.39
MAOB P27338 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
POLB P06746 1/20 0.39
LMNA P02545 2/20 0.38
CYP1A2 P05177 2/20 0.38

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
SCHEMBL194632 0.79 ELANE (0.46) TDP1TSHRALDH1A1MAPTRAB9A
SCHEMBL614263 0.77 KMT2A (0.63) TDP1TSHRMAPK1ALDH1A1CYP3A4
Hydrochloric Acid SCHEMBL27542343 0.75 KMT2A (0.61) TDP1TSHRALDH1A1CYP3A4MAOA
SCHEMBL27716548 0.75 KMT2A (0.61) TDP1TSHRALDH1A1CYP3A4MAOA
SCHEMBL11229887 0.74 TDP1 (0.45) TDP1TSHRMAPK1ALDH1A1CYP3A4
Butane SCHEMBL19439085 0.71 CYP3A4 (0.47) TDP1TSHRMAPK1ALDH1A1CYP3A4
Propane SCHEMBL6912202 0.70 TDP1 (0.56) TDP1TSHRMAPK1ALDH1A1CYP3A4
SCHEMBL11126719 0.70 TDP1 (0.48) TDP1TSHRMAPK1ALDH1A1CYP3A4
SCHEMBL8975663 0.70 TDP1 (0.48) TDP1TSHRMAPK1ALDH1A1CYP3A4
SCHEMBL9195477 0.69 LMNA (0.56) TDP1TSHRALDH1A1CYP3A4MAOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0205177-B1 METHOD OF ASSAYING MYOSIN LIGHT CHAIN Yamasa Shoyu Kabushiki Kaisha (JP) 1992-09-02 EP disclosed
EP-0478017-A1 Monoclonal antibody with specificity for human myosin light chains Yamasa Shoyu Kabushiki Kaisha (JP) 1992-04-01 EP disclosed
EP-0423333-A1 ANTI-ENDOSERINE ANTIBODY Yamasa Shoyu Kabushiki Kaisha (JP) 1991-04-24 EP disclosed
EP-0205177-A2 Method of assaying myosin light chain Yamasa Shoyu Kabushiki Kaisha (JP) 1986-12-17 EP disclosed
US-4342833-A CHEMICALLY BONDED TO CYA OGEN BROMIDE ACTIVATED AGAROSE BETHESDA RESEARCH LABORATORY (US) 1982-08-03 US disclosed
US-4180383-A Chamber holder for immobilized immunoadsorbent BECTON, DICKINSON AND COMPANY (US) 1979-12-25 US disclosed
US-4166102-A IMMOBILIZED IMMUNOADSORBENT BECTON, DICKINSON AND COMPANY (US) 1979-08-28 US disclosed
US-4108975-A REUSABLE IMMUNOADSORBENT BECTON, DICKINSON AND COMPANY (US) 1978-08-22 US disclosed
US-4108976-A AUTOMATED DIRECT SERUM RADIOIMMUNOASSAY BECTON, DICKINSON AND COMPANY (US) 1978-08-22 US disclosed
US-4059685-A Immobilized immunoadsorbent SUMMA CORPORATION (US) 1977-11-22 US disclosed
US-RE29480-E Method for determining vitamin B12 and reagent therefor PHARMACIA AB (SW) 1977-11-22 US disclosed
US-RE29474-E Method for the determination of proteins and polypeptides PHARMACIA AB (SW) 1977-11-15 US disclosed